data_6a87_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6a87 _Structure_validation_residue.Date_analyzed 2019-04-05 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.515 2.818 0 N-CA-C 110.94 -0.022 . . . . 74.43 110.94 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -94.66 122.72 0.36 Allowed 'Trans proline' 0 C--O 1.192 -1.822 0 C-N-CA 122.712 2.275 . . . . 64.44 107.087 167.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.9 t -108.14 118.66 52.02 Favored Pre-proline 0 N--CA 1.437 -1.113 0 CA-C-O 121.06 0.457 . . . . 52.64 110.28 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -67.74 143.1 60.34 Favored 'Trans proline' 0 C--O 1.208 -1.007 0 C-N-CA 121.395 1.397 . . . . 38.61 112.755 -175.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.9 t -94.85 132.66 38.21 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.438 0 C-N-CA 124.39 1.076 . . . . 43.32 109.926 171.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -94.21 -45.05 7.69 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 127.854 2.462 . . . . 47.6 107.87 -168.263 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.7 pttt -168.08 171.18 9.78 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 108.799 -0.815 . . . . 61.83 108.799 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.8 mt -129.25 149.81 50.89 Favored 'General case' 0 C--O 1.215 -0.714 0 O-C-N 124.513 1.133 . . . . 55.15 111.624 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 23.1 m -135.62 160.39 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.704 0 CA-C-N 114.272 -1.331 . . . . 47.09 107.966 166.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 38.7 m -131.23 148.39 52.69 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 124.753 1.283 . . . . 58.79 109.695 170.384 -52.208 -104.822 103.583 106.966 2.042 107.742 -78.874 -70.103 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -127.96 117.21 21.32 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 113.514 -1.676 . . . . 54.19 108.554 -172.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.92 -16.37 80.84 Favored Glycine 0 N--CA 1.474 1.176 0 O-C-N 123.569 0.543 . . . . 61.92 113.614 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -75.51 -49.24 19.32 Favored 'General case' 0 C--O 1.221 -0.447 0 N-CA-C 107.895 -1.15 . . . . 57.48 107.895 174.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 33.8 p -88.64 -17.49 29.94 Favored 'General case' 0 C--O 1.212 -0.911 0 O-C-N 124.225 0.953 . . . . 51.52 111.699 -173.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 57.29 40.51 27.72 Favored 'General case' 0 C--O 1.217 -0.627 0 O-C-N 121.557 -0.714 . . . . 69.59 109.903 -173.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -120.96 139.49 53.18 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.115 0.966 . . . . 57.39 110.298 173.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 92.1 m -97.56 139.33 33.63 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 107.581 -1.266 . . . . 57.4 107.581 163.018 -70.103 -78.874 103.583 107.742 2.042 106.966 -104.822 -52.208 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 56.8 m -129.98 125.54 35.64 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-N 114.706 -1.133 . . . . 40.82 108.267 -173.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.49 126.83 50.87 Favored 'General case' 0 N--CA 1.438 -1.025 0 O-C-N 124.082 0.864 . . . . 40.49 110.488 175.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -83.14 139.86 32.94 Favored 'General case' 0 N--CA 1.424 -1.736 0 N-CA-C 107.388 -1.338 . . . . 53.74 107.388 174.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 43.8 mt -110.67 145.62 37.63 Favored 'General case' 0 N--CA 1.438 -1.064 0 O-C-N 125.038 1.461 . . . . 43.78 112.005 -174.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -85.46 92.8 8.6 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.013 -0.994 . . . . 53.64 109.73 167.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -170.6 138.51 1.47 Allowed 'General case' 0 C--O 1.248 1.023 0 O-C-N 122.009 -0.432 . . . . 46.69 110.415 -170.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.41 -124.28 32.74 Favored Glycine 0 C--O 1.243 0.685 0 C-N-CA 124.857 1.218 . . . . 43.93 111.865 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.3 p-10 -83.67 4.02 30.45 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 114.421 -0.889 . . . . 47.38 112.438 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 84.59 8.2 83.36 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-O 118.458 -1.19 . . . . 42.85 114.855 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -118.18 16.71 14.05 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 119.562 1.681 . . . . 65.4 112.948 -176.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -86.25 141.02 29.59 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.454 -0.572 . . . . 41.84 109.454 171.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.2 m -131.61 164.54 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.936 0 CA-C-O 122.846 1.308 . . . . 40.87 110.772 170.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -119.08 139.33 51.93 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 114.078 -1.419 . . . . 38.77 108.193 169.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -135.08 142.88 46.39 Favored 'General case' 0 C--O 1.211 -0.943 0 O-C-N 123.75 0.656 . . . . 48.06 111.051 -168.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -152.86 157.21 40.37 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 122.289 1.043 . . . . 46.27 110.008 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -67.03 139.95 57.66 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 112.991 -1.913 . . . . 55.8 108.669 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.8 t -143.37 156.68 44.74 Favored 'General case' 0 N--CA 1.424 -1.766 0 CA-C-N 115.333 -0.849 . . . . 50.14 109.658 175.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -88.27 150.11 23.44 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 107.836 -1.172 . . . . 50.11 107.836 162.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.6 t -140.1 135.43 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 106.914 -1.513 . . . . 60.19 106.914 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -170.09 156.11 5.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 123.691 0.62 . . . . 58.18 111.246 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -76.1 125.92 30.04 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 113.498 -1.683 . . . . 72.46 107.753 172.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.3 t -90.5 176.23 6.78 Favored 'General case' 0 N--CA 1.425 -1.719 0 C-N-CA 119.146 -1.022 . . . . 75.48 110.166 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.7 t . . . . . 0 CA--C 1.542 0.653 0 CA-C-N 113.813 -1.54 . . . . 102.28 109.335 168.926 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.988 0 CA-C-O 121.634 0.73 . . . . 72.8 109.634 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -80.01 144.86 17.16 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 121.16 1.24 . . . . 64.9 109.715 -165.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 35.0 m -122.86 155.34 63.74 Favored Pre-proline 0 N--CA 1.427 -1.614 0 N-CA-C 108.368 -0.975 . . . . 49.71 108.368 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -62.56 145.86 95.38 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.212 1.275 . . . . 42.76 113.015 178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 55.8 t -91.59 124.03 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 CA-C-N 114.937 -1.029 . . . . 41.57 109.359 163.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.69 -41.64 16.08 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 125.813 1.645 . . . . 58.47 110.171 -176.903 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -161.78 164.59 28.82 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 122.527 1.156 . . . . 64.45 113.81 171.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 20.2 mt -119.14 139.02 52.51 Favored 'General case' 0 N--CA 1.426 -1.668 0 CA-C-N 112.612 -2.085 . . . . 53.0 110.732 173.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 1.5 t -136.35 162.51 35.54 Favored 'Isoleucine or valine' 0 N--CA 1.38 -3.974 0 N-CA-C 104.38 -2.452 . . . . 49.87 104.38 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 7.1 t -144.82 128.78 17.47 Favored 'General case' 0 N--CA 1.417 -2.116 0 N-CA-C 107.682 -1.229 . . . . 59.17 107.682 -172.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -80.42 137.43 36.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 119.49 -0.884 . . . . 56.52 108.774 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -68.36 -25.3 74.8 Favored Glycine 0 N--CA 1.489 2.178 0 C-N-CA 125.313 1.435 . . . . 46.71 115.416 -175.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -103.68 -46.14 4.61 Favored 'General case' 0 C--O 1.195 -1.782 0 CA-C-O 117.906 -1.045 . . . . 43.18 110.377 -171.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 65.0 p -88.06 -21.52 24.7 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 113.561 0.949 . . . . 42.37 113.561 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' TYR . . . . . . . . . . . . . 16.1 m-30 57.92 29.7 18.02 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 109.672 -0.492 . . . . 44.08 109.672 -168.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -76.57 132.73 39.66 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 107.745 -1.205 . . . . 84.0 107.745 169.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' CYS . . . . . . . . . . . . . 5.0 t -100.88 125.37 47.42 Favored 'General case' 0 N--CA 1.412 -2.35 0 CA-C-O 118.411 -0.804 . . . . 57.72 110.253 -179.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 57.5 m -116.26 123.42 47.67 Favored 'General case' 0 N--CA 1.483 1.225 0 O-C-N 123.932 0.77 . . . . 42.85 112.028 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.27 118.14 36.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.404 1.482 . . . . 40.96 110.563 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -85.14 122.61 29.58 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.255 1.022 . . . . 58.19 109.469 177.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 21.9 mt -92.67 135.75 33.82 Favored 'General case' 0 C--O 1.2 -1.506 0 O-C-N 123.585 0.553 . . . . 42.47 111.596 -173.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -81.75 94.82 7.09 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.022 -1.103 . . . . 55.38 108.022 169.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -167.09 138.98 3.31 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 123.631 0.772 . . . . 47.57 111.027 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 49.6 -121.05 8.43 Favored Glycine 0 C--N 1.345 1.078 0 O-C-N 123.71 0.631 . . . . 45.09 111.897 171.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 55.6 p30 -81.72 -3.28 53.3 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-O 119.028 -0.511 . . . . 50.3 111.241 -171.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.76 11.29 79.78 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 120.035 -0.314 . . . . 49.15 113.251 173.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -113.85 8.32 17.29 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 117.9 0.85 . . . . 81.56 110.531 -171.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -80.09 140.97 36.23 Favored 'General case' 0 N--CA 1.42 -1.946 0 CA-C-O 118.715 -0.66 . . . . 54.88 110.422 173.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 35.2 m -136.18 164.13 32.42 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 O-C-N 125.085 1.491 . . . . 49.99 110.931 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -121.77 149.45 43.28 Favored 'General case' 0 C--O 1.257 1.452 0 CA-C-N 114.021 -1.445 . . . . 46.14 107.365 170.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -146.59 144.46 29.56 Favored 'General case' 0 N--CA 1.422 -1.83 0 C-N-CA 119.461 -0.896 . . . . 64.24 110.828 -172.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 46.8 p90 -157.37 165.46 35.7 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-N 114.532 -1.213 . . . . 47.42 110.691 171.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -88.85 151.92 22.06 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 113.272 -1.786 . . . . 48.18 109.082 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 5.9 p -146.58 166.95 24.96 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 113.515 -1.675 . . . . 38.95 109.965 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.19 128.77 55.0 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 113.654 -1.612 . . . . 47.83 108.658 168.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 44.6 t -109.32 138.24 37.6 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.819 0 CA-C-N 114.737 -1.12 . . . . 49.97 109.612 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' PHE . . . . . . . . . . . . . 42.5 p90 -160.53 167.45 27.14 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 123.506 1.622 . . . . 52.58 111.963 177.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -98.63 132.41 44.05 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 112.924 -1.944 . . . . 53.77 109.238 -174.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 18.9 p -104.88 176.19 5.24 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.261 1.029 . . . . 53.32 111.9 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.239 0.509 0 CA-C-N 113.829 -1.532 . . . . 79.75 109.218 164.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 109.851 -0.425 . . . . 69.3 109.851 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -66.47 128.13 18.62 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 N-CA-C 105.931 -2.373 . . . . 59.5 105.931 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 33.3 m -124.34 148.27 57.61 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 107.485 -1.302 . . . . 47.84 107.485 169.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -61.84 143.84 96.24 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 122.493 2.129 . . . . 41.65 112.145 -174.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' VAL . . . . . . . . . . . . . 90.9 t -87.74 127.56 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 N-CA-C 107.302 -1.37 . . . . 44.93 107.302 164.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' THR . . . . . . . . . . . . . 58.1 p -98.05 -24.58 15.27 Favored 'General case' 0 C--O 1.241 0.654 0 O-C-N 124.323 1.015 . . . . 42.8 110.871 -173.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 24.8 tttm -159.86 145.77 15.73 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 115.441 -0.8 . . . . 80.8 109.288 -174.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' LEU . . . . . . . . . . . . . 25.1 tp -135.16 124.64 24.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.292 -0.867 . . . . 46.86 109.758 -176.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 20.2 m -128.16 159.23 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 108.355 -0.98 . . . . 44.21 108.355 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' CYS . . . . . . . . . . . . . 50.7 t -129.22 138.51 51.73 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 124.753 1.283 . . . . 47.42 109.791 174.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -110.77 113.74 26.57 Favored 'General case' 0 C--O 1.247 0.961 0 CA-C-O 121.288 0.566 . . . . 57.26 109.914 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.03 -47.47 72.9 Favored Glycine 0 C--O 1.247 0.923 0 C-N-CA 125.15 1.357 . . . . 64.95 113.853 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.37 -30.22 37.9 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-O 118.681 -0.676 . . . . 88.75 110.704 -173.425 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' THR . . . . . . . . . . . . . 5.1 t -87.8 -15.88 35.66 Favored 'General case' 0 C--O 1.203 -1.371 0 C-N-CA 118.136 -1.425 . . . . 71.48 112.348 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' TYR . . . . . . . . . . . . . 71.6 m-85 61.49 45.43 8.36 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-N 120.455 1.48 . . . . 78.39 110.518 -176.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -137.93 133.39 33.7 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.152 -0.476 . . . . 65.81 109.943 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' CYS . . . . . . . . . . . . . 22.3 m -88.09 139.84 30.1 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 124.926 1.391 . . . . 56.98 109.56 164.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' THR . . . . . . . . . . . . . 65.7 m -122.25 123.31 41.15 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 115.052 -0.976 . . . . 45.41 109.301 172.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -102.67 125.07 49.26 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 124.444 1.097 . . . . 38.6 108.045 173.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -84.47 140.49 31.45 Favored 'General case' 0 C--O 1.273 2.318 0 CA-C-N 115.807 -0.633 . . . . 42.56 109.851 170.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 52.1 mt -115.15 141.26 48.26 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-O 122.587 1.184 . . . . 44.15 112.077 -170.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -82.58 85.87 6.91 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 114.382 -1.281 . . . . 52.46 108.78 172.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -163.39 142.4 8.27 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.57 0.7 . . . . 93.03 110.326 176.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' GLY . . . . . . . . . . . . . . . 64.78 -135.17 38.02 Favored Glycine 0 C--O 1.209 -1.423 0 CA-C-N 115.813 -0.631 . . . . 59.36 111.62 163.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 55.5 p-10 -80.72 -0.47 38.52 Favored 'General case' 0 C--O 1.215 -0.732 0 C-N-CA 122.95 0.5 . . . . 54.66 110.503 -176.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' GLY . . . . . . . . . . . . . . . 87.89 9.51 71.03 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-O 118.451 -1.194 . . . . 47.47 111.405 169.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -103.85 15.05 29.58 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-O 121.932 0.872 . . . . 98.03 111.453 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -88.9 137.33 32.42 Favored 'General case' 0 N--CA 1.433 -1.293 0 O-C-N 120.976 -1.078 . . . . 64.69 109.649 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -137.35 170.55 17.58 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 121.632 0.73 . . . . 46.93 109.41 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.81 144.99 51.32 Favored 'General case' 0 N--CA 1.41 -2.457 0 N-CA-C 106.915 -1.513 . . . . 47.22 106.915 174.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -140.92 145.44 36.09 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 109.324 -0.621 . . . . 50.97 109.324 -175.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' TRP . . . . . . . . . . . . . 40.8 p90 -147.61 157.34 43.51 Favored 'General case' 0 C--O 1.213 -0.837 0 O-C-N 124.712 1.258 . . . . 43.08 109.347 171.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -70.66 146.04 50.22 Favored 'General case' 0 C--O 1.194 -1.828 0 C-N-CA 124.355 1.062 . . . . 61.35 109.24 177.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' THR . . . . . . . . . . . . . 33.5 p -143.45 151.27 40.15 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 108.125 -1.065 . . . . 55.16 108.125 173.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.18 140.48 47.03 Favored 'General case' 0 C--O 1.249 1.032 0 N-CA-C 107.181 -1.415 . . . . 57.34 107.181 160.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 92.6 t -125.66 135.72 63.06 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.592 0 N-CA-C 108.553 -0.906 . . . . 57.21 108.553 176.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -166.44 166.06 16.65 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-O 122.666 1.222 . . . . 61.13 112.816 177.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -89.77 128.96 36.22 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-N 113.267 -1.788 . . . . 58.35 108.796 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 75.1 p -85.34 164.41 17.99 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 118.959 -1.096 . . . . 67.91 110.242 179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' THR . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.537 0.473 0 CA-C-N 113.082 -1.872 . . . . 100.3 109.367 174.253 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.203 0 CA-C-O 120.468 0.175 . . . . 64.08 111.128 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.03 128.34 22.69 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 123.254 2.636 . . . . 56.64 113.704 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' VAL . . . . . . . . . . . . . 30.1 m -127.63 153.06 77.65 Favored Pre-proline 0 N--CA 1.42 -1.927 0 O-C-N 124.753 1.283 . . . . 49.72 108.075 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -77.17 152.11 30.79 Favored 'Trans proline' 0 C--O 1.246 0.903 0 C-N-CA 121.275 1.317 . . . . 44.46 111.684 -173.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' VAL . . . . . . . . . . . . . 58.5 t -93.03 125.7 45.55 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.536 0 O-C-N 124.712 1.258 . . . . 47.66 108.251 170.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' THR . . . . . . . . . . . . . 40.3 p -86.02 -43.54 13.05 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 109.769 -0.456 . . . . 52.71 109.769 178.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' LYS . . . . . . . . . . . . . 12.7 mttp -142.19 143.88 33.14 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.282 0.563 . . . . 81.68 110.128 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' LEU . . . . . . . . . . . . . 12.9 tp -121.63 137.02 54.92 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.485 1.514 . . . . 51.32 108.786 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' VAL . . . . . . . . . . . . . 20.6 m -140.49 155.42 22.98 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.37 0 N-CA-C 106.839 -1.541 . . . . 42.04 106.839 174.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' CYS . . . . . . . . . . . . . 87.9 m -131.25 152.37 50.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 124.307 1.004 . . . . 46.67 109.926 173.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -134.02 114.07 12.81 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 107.325 -1.361 . . . . 43.29 107.325 -168.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.99 -0.88 89.78 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 115.499 -0.773 . . . . 34.57 112.263 -174.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -98.04 -40.93 8.2 Favored 'General case' 0 C--O 1.212 -0.91 0 C-N-CA 122.834 0.454 . . . . 52.81 110.62 171.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' THR . . . . . . . . . . . . . 80.6 p -88.74 -17.75 29.22 Favored 'General case' 0 C--O 1.2 -1.525 0 C-N-CA 119.688 -0.805 . . . . 36.72 111.926 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 60.88 43.51 11.76 Favored 'General case' 0 C--O 1.212 -0.902 0 N-CA-C 108.149 -1.056 . . . . 36.56 108.149 -174.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -127.02 137.82 53.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-O 122.698 1.237 . . . . 43.23 110.655 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' CYS . . . . . . . . . . . . . 49.4 t -99.88 122.88 43.48 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 113.917 -1.492 . . . . 52.83 109.182 166.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' THR . . . . . . . . . . . . . 77.0 m -107.99 131.72 54.27 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 108.803 -0.814 . . . . 42.5 108.803 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.05 112.71 20.6 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.63 1.172 . . . . 38.34 110.084 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -76.72 135.33 39.04 Favored 'General case' 0 C--O 1.253 1.271 0 N-CA-C 108.682 -0.858 . . . . 46.45 108.682 176.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' LEU . . . . . . . . . . . . . 31.2 mt -108.26 148.09 30.48 Favored 'General case' 0 C--O 1.208 -1.121 0 N-CA-C 108.695 -0.854 . . . . 43.11 108.695 -171.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -92.6 93.07 8.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 115.229 -0.896 . . . . 50.69 109.004 170.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -167.11 144.34 4.64 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-O 122.836 1.303 . . . . 43.02 110.679 -172.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.28 -122.35 7.18 Favored Glycine 0 N--CA 1.415 -2.761 0 CA-C-N 114.075 -1.42 . . . . 35.43 110.194 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' ASP . . . . . . . . . . . . . 38.4 p-10 -93.25 11.82 26.68 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 113.786 -1.207 . . . . 35.47 111.736 -165.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.25 5.35 89.76 Favored Glycine 0 C--N 1.341 0.822 0 C-N-CA 121.112 -0.566 . . . . 38.11 113.962 174.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 3.4 mtmm -113.15 22.35 14.42 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 117.603 0.702 . . . . 56.59 112.244 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -96.06 137.92 34.44 Favored 'General case' 0 C--O 1.265 1.891 0 CA-C-O 122.77 1.271 . . . . 39.34 110.153 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' VAL . . . . . . . . . . . . . 97.1 t -144.3 142.12 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 CA-C-N 114.038 -1.437 . . . . 44.05 107.584 -168.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ALA . . . . . . . . . . . . . . . -114.66 152.53 31.77 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 107.127 -1.435 . . . . 39.27 107.127 172.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -156.71 138.28 14.06 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 117.325 -1.75 . . . . 36.05 108.89 -174.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' TRP . . . . . . . . . . . . . 46.8 p90 -146.67 162.86 37.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.829 -0.749 . . . . 38.23 109.133 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -74.38 150.86 39.85 Favored 'General case' 0 N--CA 1.414 -2.27 0 O-C-N 126.273 2.233 . . . . 42.24 107.715 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' THR . . . . . . . . . . . . . 5.4 t -156.72 150.14 24.36 Favored 'General case' 0 N--CA 1.426 -1.654 0 O-C-N 124.532 1.145 . . . . 38.08 108.488 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.0 146.04 35.62 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 106.982 -1.488 . . . . 36.02 106.982 166.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' VAL . . . . . . . . . . . . . 81.7 t -130.74 131.72 64.5 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 N-CA-C 108.434 -0.95 . . . . 38.24 108.434 168.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -151.34 165.27 34.58 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 122.564 1.173 . . . . 43.16 112.498 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -109.8 124.8 51.92 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 112.864 -1.971 . . . . 43.92 108.762 -177.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' THR . . . . . 0.48 ' O ' ' CE ' ' F' ' 27' ' ' LYS . 38.5 p . . . . . 0 N--CA 1.502 2.162 0 CA-C-N 119.529 1.059 . . . . 60.01 112.675 -167.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 1' ' ' ALA . . . . . 0.578 ' N ' ' OD2' ' F' ' 13' ' ' ASP . . . . . . . . 0 N--CA 1.495 1.798 0 N-CA-C 110.397 -0.223 . . . . 66.4 110.397 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 2' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -63.23 132.76 37.6 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 124.232 3.288 . . . . 63.51 116.401 -174.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' VAL . . . . . . . . . . . . . 18.2 m -134.0 149.49 71.79 Favored Pre-proline 0 N--CA 1.478 0.957 0 O-C-N 124.691 1.244 . . . . 63.25 111.027 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_exo -60.75 149.64 86.82 Favored 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 123.734 2.956 . . . . 60.07 115.587 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' VAL . . . . . . . . . . . . . 99.5 t -95.52 118.56 42.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 N-CA-C 108.367 -0.975 . . . . 56.07 108.367 167.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' THR . . . . . . . . . . . . . 7.2 m -70.81 -52.42 20.62 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 124.914 1.285 . . . . 69.63 110.288 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -151.51 151.61 31.84 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 106.899 -1.519 . . . . 104.06 106.899 -170.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' LEU . . . . . . . . . . . . . 14.7 tp -127.91 135.09 49.51 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 109.277 -0.638 . . . . 57.41 109.277 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 9' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.73 155.24 30.38 Favored 'Isoleucine or valine' 0 C--O 1.243 0.721 0 N-CA-C 108.755 -0.832 . . . . 51.88 108.755 175.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 10' ' ' CYS . . . . . . . . . . . . . 63.5 m -127.65 155.27 44.17 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 107.781 -1.192 . . . . 52.42 107.781 172.056 -57.091 -37.343 -55.795 140.564 3.098 77.099 82.579 -177.902 1 1 . 1 . 001 ecloud orig full ' E' E ' 11' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -143.53 118.78 10.18 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 107.48 -1.304 . . . . 53.91 107.48 -167.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.37 -6.45 88.68 Favored Glycine 0 C--O 1.251 1.191 0 O-C-N 123.802 0.689 . . . . 46.9 113.175 -173.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 13' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -84.87 -38.07 19.89 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 107.705 -1.22 . . . . 59.95 107.705 175.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 14' ' ' THR . . . . . . . . . . . . . 9.2 t -98.76 -15.35 19.34 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-O 117.724 -1.132 . . . . 66.77 111.841 -174.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 15' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 54.98 45.96 25.32 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 125.057 1.343 . . . . 52.51 111.565 -172.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 16' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -133.34 136.19 45.23 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.31 1.444 . . . . 55.09 110.6 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 17' ' ' CYS . . . . . . . . . . . . . 50.1 t -100.63 139.24 36.58 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 113.463 -1.698 . . . . 45.14 108.245 166.734 -177.902 82.579 -55.795 77.099 3.098 140.564 -37.343 -57.091 1 1 . 1 . 001 ecloud orig full ' E' E ' 18' ' ' THR . . . . . . . . . . . . . 52.0 m -127.19 125.3 40.83 Favored 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 107.375 -1.343 . . . . 47.35 107.375 -174.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.76 123.24 47.63 Favored 'General case' 0 C--O 1.221 -0.413 0 O-C-N 123.838 0.711 . . . . 51.08 110.431 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 20' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -84.1 125.19 31.89 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.523 -0.917 . . . . 67.05 108.523 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.43 147.54 25.16 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.839 0.856 . . . . 68.81 111.71 -171.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -92.11 84.62 5.3 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.49 -0.777 . . . . 75.38 110.101 168.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -162.03 145.61 12.09 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.679 0.792 . . . . 68.38 111.055 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.63 -128.84 47.66 Favored Glycine 0 C--N 1.341 0.829 0 CA-C-N 114.644 -1.162 . . . . 69.96 112.675 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -73.81 -3.5 29.04 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.351 1.06 . . . . 88.61 113.32 176.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.71 20.51 79.71 Favored Glycine 0 N--CA 1.489 2.18 0 CA-C-N 119.276 0.944 . . . . 80.01 113.411 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 27' ' ' LYS . . . . . . . . . . . . . 10.9 mmpt? -105.54 19.77 20.01 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.736 -0.838 . . . . 95.55 108.736 175.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 28' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -97.32 138.46 34.76 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.016 -0.674 . . . . 77.71 109.464 -175.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 29' ' ' VAL . . . . . . . . . . . . . 19.6 m -133.95 167.87 25.25 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.931 0 CA-C-O 122.467 1.127 . . . . 49.87 109.861 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.59 137.34 51.65 Favored 'General case' 0 C--O 1.203 -1.348 0 CA-C-N 113.211 -1.813 . . . . 48.0 106.897 172.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 31' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -147.7 160.06 43.11 Favored 'General case' 0 C--O 1.208 -1.12 0 C-N-CA 116.665 -2.014 . . . . 55.63 113.225 172.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 32' ' ' TRP . . . . . . . . . . . . . 49.0 p90 -152.8 159.26 43.07 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 112.605 -2.089 . . . . 44.93 108.333 -171.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 33' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -70.41 153.34 43.09 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 114.803 -1.089 . . . . 65.27 110.171 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 34' ' ' THR . . . . . . . . . . . . . 5.9 t -157.31 148.17 21.48 Favored 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 107.753 -1.203 . . . . 45.47 107.753 176.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.16 148.99 49.13 Favored 'General case' 0 N--CA 1.42 -1.937 0 O-C-N 125.32 1.638 . . . . 34.94 109.052 159.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 36' ' ' VAL . . . . . . . . . . . . . 62.6 t -137.84 116.61 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.104 0 N-CA-C 107.005 -1.48 . . . . 40.34 107.005 173.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 37' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -140.6 167.15 22.85 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 123.653 0.596 . . . . 39.2 110.886 -178.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 38' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -111.81 117.55 33.12 Favored 'General case' 0 C--O 1.258 1.514 0 C-N-CA 126.277 1.831 . . . . 46.59 108.804 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 39' ' ' THR . . . . . . . . . . . . . 28.4 p -76.73 148.54 36.67 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 123.405 1.574 . . . . 58.12 108.473 177.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 40' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.427 -1.616 0 CA-C-O 116.378 -1.772 . . . . 91.86 109.565 -168.676 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 108.483 -0.932 . . . . 47.49 108.483 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 2' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -69.39 138.97 40.32 Favored 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 121.796 1.664 . . . . 53.42 109.019 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' VAL . . . . . . . . . . . . . 31.5 m -129.95 155.59 80.37 Favored Pre-proline 0 N--CA 1.411 -2.39 0 N-CA-C 107.683 -1.229 . . . . 44.24 107.683 173.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -62.31 151.18 84.0 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.913 2.409 . . . . 46.24 112.763 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.35 128.01 45.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 O-C-N 125.984 2.053 . . . . 52.43 109.524 170.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -83.09 -51.68 7.31 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.282 -1.326 . . . . 65.87 108.592 -176.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 7' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -147.93 149.23 31.82 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.339 -0.846 . . . . 94.89 109.217 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 8' ' ' LEU . . . . . . . . . . . . . 26.3 tp -130.53 130.16 43.77 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 124.274 1.03 . . . . 53.92 109.844 -178.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 9' ' ' VAL . . . . . . . . . . . . . 10.4 m -142.27 155.2 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 108.246 -1.02 . . . . 48.54 108.246 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 10' ' ' CYS . . . . . . . . . . . . . 57.9 m -128.74 173.65 10.14 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.709 -0.478 . . . . 59.27 109.709 172.955 -54.532 -99.884 104.151 105.843 2.036 106.393 -83.649 -63.361 1 1 . 1 . 001 ecloud orig full ' F' F ' 11' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -157.93 119.51 3.6 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 123.345 0.403 . . . . 55.9 111.339 -172.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 12' ' ' GLY . . . . . . . . . . . . . . . -81.18 -10.89 84.22 Favored Glycine 0 C--O 1.249 1.04 0 CA-C-N 115.491 -0.777 . . . . 51.03 113.974 -174.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 13' ' ' ASP . . . . . 0.578 ' OD2' ' N ' ' E' ' 1' ' ' ALA . 21.3 m-20 -82.4 -32.89 28.89 Favored 'General case' 0 C--O 1.251 1.178 0 C-N-CA 119.808 -0.757 . . . . 55.88 109.755 170.343 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 14' ' ' THR . . . . . . . . . . . . . 29.6 p -100.85 -22.14 14.92 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 118.966 -0.54 . . . . 41.22 112.063 -173.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 15' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 62.49 43.55 7.77 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.541 1.136 . . . . 88.31 108.092 -179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 16' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -137.44 137.13 38.43 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.097 -0.956 . . . . 46.84 109.421 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 17' ' ' CYS . . . . . . . . . . . . . 74.6 m -102.06 137.02 40.89 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 126.048 2.092 . . . . 52.9 107.642 163.773 -63.361 -83.649 104.151 106.393 2.036 105.843 -99.884 -54.532 1 1 . 1 . 001 ecloud orig full ' F' F ' 18' ' ' THR . . . . . . . . . . . . . 44.7 m -123.04 132.63 54.2 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.286 1.434 . . . . 39.1 109.21 -171.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.88 114.68 21.36 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 123.993 0.808 . . . . 41.81 109.542 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 20' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -83.74 140.31 32.19 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 106.165 -1.791 . . . . 48.85 106.165 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 21' ' ' LEU . . . . . . . . . . . . . 85.0 mt -115.71 144.66 43.64 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-O 122.867 1.318 . . . . 45.88 111.086 -166.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 22' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -89.27 95.62 10.37 Favored 'General case' 0 N--CA 1.416 -2.129 0 CA-C-N 113.136 -1.847 . . . . 64.21 107.865 170.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -169.41 143.84 2.93 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.524 -0.762 . . . . 49.57 108.97 178.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.33 -125.26 35.67 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.286 -0.725 . . . . 52.54 111.286 171.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 39.9 p-10 -90.0 5.42 46.63 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.954 1.302 . . . . 67.34 111.613 -174.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.43 10.89 84.8 Favored Glycine 0 N--CA 1.471 1.024 0 CA-C-N 118.343 0.519 . . . . 51.74 113.607 176.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 27' ' ' LYS . . . . . 0.48 ' CE ' ' O ' ' D' ' 39' ' ' THR . 19.0 mtpt -108.49 14.28 24.78 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.729 -1.454 . . . . 83.85 110.729 -175.216 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 28' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -91.82 127.61 37.35 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 123.243 0.617 . . . . 49.93 109.958 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 29' ' ' VAL . . . . . . . . . . . . . 1.4 m -129.1 143.64 40.61 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.872 0 CA-C-O 121.436 0.636 . . . . 45.0 109.98 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 30' ' ' ALA . . . . . . . . . . . . . . . -99.67 142.42 31.18 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 123.36 0.664 . . . . 40.12 110.223 166.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 31' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -149.53 137.81 20.65 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 122.454 1.121 . . . . 36.45 111.846 -176.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 32' ' ' TRP . . . . . . . . . . . . . 47.6 p90 -146.74 161.27 40.97 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 114.349 -1.296 . . . . 38.52 110.32 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 33' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -71.77 145.74 48.53 Favored 'General case' 0 C--O 1.246 0.906 0 CA-C-N 112.966 -1.924 . . . . 62.04 110.472 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 34' ' ' THR . . . . . . . . . . . . . 15.2 t -150.43 146.94 26.98 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 114.152 -1.386 . . . . 55.69 110.726 -179.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.33 145.48 32.07 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.742 -1.577 . . . . 46.65 106.742 162.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 36' ' ' VAL . . . . . . . . . . . . . 33.2 t -127.91 139.35 52.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 107.34 -1.356 . . . . 61.72 107.34 169.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -164.69 164.83 21.28 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.84 1.305 . . . . 81.35 111.506 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 38' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -92.74 147.39 22.9 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 113.448 -1.706 . . . . 82.76 108.823 175.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 39' ' ' THR . . . . . . . . . . . . . 55.3 p . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 121.824 0.821 . . . . 82.35 110.587 -177.184 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 101' ' ' MEE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 102' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 103' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 104' ' ' MEE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 102' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 103' ' ' MEE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.515 2.818 0 N-CA-C 110.94 -0.022 . . . . 74.43 110.94 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -94.66 122.72 0.36 Allowed 'Trans proline' 0 C--O 1.192 -1.822 0 C-N-CA 122.712 2.275 . . . . 64.44 107.087 167.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.9 t -108.14 118.66 52.02 Favored Pre-proline 0 N--CA 1.437 -1.113 0 CA-C-O 121.06 0.457 . . . . 52.64 110.28 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -67.74 143.1 60.34 Favored 'Trans proline' 0 C--O 1.208 -1.007 0 C-N-CA 121.395 1.397 . . . . 38.61 112.755 -175.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.9 t -94.85 132.66 38.21 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.438 0 C-N-CA 124.39 1.076 . . . . 43.32 109.926 171.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -94.21 -45.05 7.69 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 127.854 2.462 . . . . 47.6 107.87 -168.263 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.7 pttt -168.08 171.18 9.78 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 108.799 -0.815 . . . . 61.83 108.799 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 19' ' ' ALA . 72.8 mt -129.25 149.81 50.89 Favored 'General case' 0 C--O 1.215 -0.714 0 O-C-N 124.513 1.133 . . . . 55.15 111.624 179.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 23.1 m -135.62 160.39 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.704 0 CA-C-N 114.272 -1.331 . . . . 47.09 107.966 166.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 38.7 m -131.23 148.39 52.69 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 124.753 1.283 . . . . 60.38 109.695 170.384 -52.208 -104.822 103.583 106.966 2.042 107.742 -78.874 -70.103 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -127.96 117.21 21.32 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 113.514 -1.676 . . . . 54.19 108.554 -172.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.92 -16.37 80.84 Favored Glycine 0 N--CA 1.474 1.176 0 O-C-N 123.569 0.543 . . . . 61.92 113.614 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -75.51 -49.24 19.32 Favored 'General case' 0 C--O 1.221 -0.447 0 N-CA-C 107.895 -1.15 . . . . 57.48 107.895 174.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 33.8 p -88.64 -17.49 29.94 Favored 'General case' 0 C--O 1.212 -0.911 0 O-C-N 124.225 0.953 . . . . 51.52 111.699 -173.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 57.29 40.51 27.72 Favored 'General case' 0 C--O 1.217 -0.627 0 O-C-N 121.557 -0.714 . . . . 69.59 109.903 -173.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -120.96 139.49 53.18 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.115 0.966 . . . . 57.39 110.298 173.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' CYS . . . . . 0.407 ' SG ' HG21 ' A' ' 34' ' ' THR . 92.1 m -97.56 139.33 33.63 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 107.581 -1.266 . . . . 57.4 107.581 163.018 -70.103 -78.874 103.583 107.742 2.042 106.966 -104.822 -52.208 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 56.8 m -129.98 125.54 35.64 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-N 114.706 -1.133 . . . . 40.82 108.267 -173.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . 0.411 ' HA ' HD23 ' A' ' 8' ' ' LEU . . . -103.49 126.83 50.87 Favored 'General case' 0 N--CA 1.438 -1.025 0 O-C-N 124.082 0.864 . . . . 40.49 110.488 175.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -83.14 139.86 32.94 Favored 'General case' 0 N--CA 1.424 -1.736 0 N-CA-C 107.388 -1.338 . . . . 53.74 107.388 174.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 43.8 mt -110.67 145.62 37.63 Favored 'General case' 0 N--CA 1.438 -1.064 0 O-C-N 125.038 1.461 . . . . 43.78 112.005 -174.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -85.46 92.8 8.6 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.013 -0.994 . . . . 53.64 109.73 167.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -170.6 138.51 1.47 Allowed 'General case' 0 C--O 1.248 1.023 0 O-C-N 122.009 -0.432 . . . . 46.69 110.415 -170.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.41 -124.28 32.74 Favored Glycine 0 C--O 1.243 0.685 0 C-N-CA 124.857 1.218 . . . . 43.93 111.865 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.3 p-10 -83.67 4.02 30.45 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 114.421 -0.889 . . . . 47.38 112.438 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 84.59 8.2 83.36 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-O 118.458 -1.19 . . . . 42.85 114.855 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -118.18 16.71 14.05 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 119.562 1.681 . . . . 65.4 112.948 -176.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -86.25 141.02 29.59 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.454 -0.572 . . . . 41.84 109.454 171.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.2 m -131.61 164.54 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.936 0 CA-C-O 122.846 1.308 . . . . 40.87 110.772 170.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -119.08 139.33 51.93 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 114.078 -1.419 . . . . 38.77 108.193 169.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -135.08 142.88 46.39 Favored 'General case' 0 C--O 1.211 -0.943 0 O-C-N 123.75 0.656 . . . . 48.06 111.051 -168.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -152.86 157.21 40.37 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 122.289 1.043 . . . . 46.27 110.008 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -67.03 139.95 57.66 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 112.991 -1.913 . . . . 55.8 108.669 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . 0.407 HG21 ' SG ' ' A' ' 17' ' ' CYS . 8.8 t -143.37 156.68 44.74 Favored 'General case' 0 N--CA 1.424 -1.766 0 CA-C-N 115.333 -0.849 . . . . 50.14 109.658 175.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -88.27 150.11 23.44 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 107.836 -1.172 . . . . 50.11 107.836 162.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.6 t -140.1 135.43 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 106.914 -1.513 . . . . 60.19 106.914 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -170.09 156.11 5.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 123.691 0.62 . . . . 58.18 111.246 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -76.1 125.92 30.04 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 113.498 -1.683 . . . . 72.46 107.753 172.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . 0.419 HG21 ' O ' ' C' ' 105' ' ' HOH . 2.3 t -90.5 176.23 6.78 Favored 'General case' 0 N--CA 1.425 -1.719 0 C-N-CA 119.146 -1.022 . . . . 75.48 110.166 179.11 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.7 t . . . . . 0 CA--C 1.542 0.653 0 CA-C-N 113.813 -1.54 . . . . 102.28 109.335 168.926 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.988 0 CA-C-O 121.634 0.73 . . . . 72.8 109.634 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -80.01 144.86 17.16 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 121.16 1.24 . . . . 64.9 109.715 -165.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 35.0 m -122.86 155.34 63.74 Favored Pre-proline 0 N--CA 1.427 -1.614 0 N-CA-C 108.368 -0.975 . . . . 49.71 108.368 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -62.56 145.86 95.38 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.212 1.275 . . . . 42.76 113.015 178.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 55.8 t -91.59 124.03 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 CA-C-N 114.937 -1.029 . . . . 41.57 109.359 163.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.69 -41.64 16.08 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 125.813 1.645 . . . . 58.47 110.171 -176.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -161.78 164.59 28.82 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 122.527 1.156 . . . . 64.45 113.81 171.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 20.2 mt -119.14 139.02 52.51 Favored 'General case' 0 N--CA 1.426 -1.668 0 CA-C-N 112.612 -2.085 . . . . 53.0 110.732 173.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 1.5 t -136.35 162.51 35.54 Favored 'Isoleucine or valine' 0 N--CA 1.38 -3.974 0 N-CA-C 104.38 -2.452 . . . . 49.87 104.38 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 7.1 t -144.82 128.78 17.47 Favored 'General case' 0 N--CA 1.417 -2.116 0 N-CA-C 107.682 -1.229 . . . . 59.17 107.682 -172.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -80.42 137.43 36.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 119.49 -0.884 . . . . 56.52 108.774 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -68.36 -25.3 74.8 Favored Glycine 0 N--CA 1.489 2.178 0 C-N-CA 125.313 1.435 . . . . 46.71 115.416 -175.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -103.68 -46.14 4.61 Favored 'General case' 0 C--O 1.195 -1.782 0 CA-C-O 117.906 -1.045 . . . . 43.18 110.377 -171.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 65.0 p -88.06 -21.52 24.7 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 113.561 0.949 . . . . 42.37 113.561 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' TYR . . . . . . . . . . . . . 16.1 m-30 57.92 29.7 18.02 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 109.672 -0.492 . . . . 44.08 109.672 -168.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -76.57 132.73 39.66 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 107.745 -1.205 . . . . 84.0 107.745 169.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' CYS . . . . . . . . . . . . . 5.0 t -100.88 125.37 47.42 Favored 'General case' 0 N--CA 1.412 -2.35 0 CA-C-O 118.411 -0.804 . . . . 57.72 110.253 -179.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 57.5 m -116.26 123.42 47.67 Favored 'General case' 0 N--CA 1.483 1.225 0 O-C-N 123.932 0.77 . . . . 42.85 112.028 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.27 118.14 36.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.404 1.482 . . . . 40.96 110.563 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -85.14 122.61 29.58 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.255 1.022 . . . . 58.19 109.469 177.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 21.9 mt -92.67 135.75 33.82 Favored 'General case' 0 C--O 1.2 -1.506 0 O-C-N 123.585 0.553 . . . . 42.47 111.596 -173.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -81.75 94.82 7.09 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.022 -1.103 . . . . 55.38 108.022 169.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -167.09 138.98 3.31 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 123.631 0.772 . . . . 47.57 111.027 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 49.6 -121.05 8.43 Favored Glycine 0 C--N 1.345 1.078 0 O-C-N 123.71 0.631 . . . . 45.09 111.897 171.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 55.6 p30 -81.72 -3.28 53.3 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-O 119.028 -0.511 . . . . 50.3 111.241 -171.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.76 11.29 79.78 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 120.035 -0.314 . . . . 49.15 113.251 173.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -113.85 8.32 17.29 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 117.9 0.85 . . . . 81.56 110.531 -171.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -80.09 140.97 36.23 Favored 'General case' 0 N--CA 1.42 -1.946 0 CA-C-O 118.715 -0.66 . . . . 54.88 110.422 173.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 35.2 m -136.18 164.13 32.42 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 O-C-N 125.085 1.491 . . . . 49.99 110.931 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -121.77 149.45 43.28 Favored 'General case' 0 C--O 1.257 1.452 0 CA-C-N 114.021 -1.445 . . . . 46.14 107.365 170.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -146.59 144.46 29.56 Favored 'General case' 0 N--CA 1.422 -1.83 0 C-N-CA 119.461 -0.896 . . . . 64.24 110.828 -172.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 46.8 p90 -157.37 165.46 35.7 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-N 114.532 -1.213 . . . . 47.42 110.691 171.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -88.85 151.92 22.06 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 113.272 -1.786 . . . . 48.18 109.082 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 5.9 p -146.58 166.95 24.96 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 113.515 -1.675 . . . . 38.95 109.965 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.19 128.77 55.0 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 113.654 -1.612 . . . . 47.83 108.658 168.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 44.6 t -109.32 138.24 37.6 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.819 0 CA-C-N 114.737 -1.12 . . . . 49.97 109.612 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' PHE . . . . . . . . . . . . . 42.5 p90 -160.53 167.45 27.14 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 123.506 1.622 . . . . 52.58 111.963 177.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -98.63 132.41 44.05 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 112.924 -1.944 . . . . 53.77 109.238 -174.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 18.9 p -104.88 176.19 5.24 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.261 1.029 . . . . 53.32 111.9 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.239 0.509 0 CA-C-N 113.829 -1.532 . . . . 79.75 109.218 164.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 109.851 -0.425 . . . . 69.3 109.851 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -66.47 128.13 18.62 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 N-CA-C 105.931 -2.373 . . . . 59.5 105.931 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 33.3 m -124.34 148.27 57.61 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 107.485 -1.302 . . . . 47.84 107.485 169.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -61.84 143.84 96.24 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 122.493 2.129 . . . . 41.65 112.145 -174.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' VAL . . . . . . . . . . . . . 90.9 t -87.74 127.56 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 N-CA-C 107.302 -1.37 . . . . 44.93 107.302 164.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' THR . . . . . . . . . . . . . 58.1 p -98.05 -24.58 15.27 Favored 'General case' 0 C--O 1.241 0.654 0 O-C-N 124.323 1.015 . . . . 42.8 110.871 -173.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 24.8 tttm -159.86 145.77 15.73 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 115.441 -0.8 . . . . 80.8 109.288 -174.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' LEU . . . . . . . . . . . . . 25.1 tp -135.16 124.64 24.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.292 -0.867 . . . . 46.86 109.758 -176.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 20.2 m -128.16 159.23 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 108.355 -0.98 . . . . 44.21 108.355 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' CYS . . . . . . . . . . . . . 50.7 t -129.22 138.51 51.73 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 124.753 1.283 . . . . 47.42 109.791 174.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ASP . . . . . 0.639 ' HB3' HG22 ' C' ' 14' ' ' THR . 42.3 t0 -110.77 113.74 26.57 Favored 'General case' 0 C--O 1.247 0.961 0 CA-C-O 121.288 0.566 . . . . 57.26 109.914 179.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.03 -47.47 72.9 Favored Glycine 0 C--O 1.247 0.923 0 C-N-CA 125.15 1.357 . . . . 64.95 113.853 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.37 -30.22 37.9 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-O 118.681 -0.676 . . . . 88.75 110.704 -173.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 14' ' ' THR . . . . . 0.639 HG22 ' HB3' ' C' ' 11' ' ' ASP . 5.1 t -87.8 -15.88 35.66 Favored 'General case' 0 C--O 1.203 -1.371 0 C-N-CA 118.136 -1.425 . . . . 71.48 112.348 175.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 15' ' ' TYR . . . . . . . . . . . . . 71.6 m-85 61.49 45.43 8.36 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-N 120.455 1.48 . . . . 78.39 110.518 -176.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -137.93 133.39 33.7 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.152 -0.476 . . . . 65.81 109.943 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' CYS . . . . . . . . . . . . . 22.3 m -88.09 139.84 30.1 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 124.926 1.391 . . . . 56.98 109.56 164.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' THR . . . . . . . . . . . . . 65.7 m -122.25 123.31 41.15 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 115.052 -0.976 . . . . 45.41 109.301 172.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -102.67 125.07 49.26 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 124.444 1.097 . . . . 38.6 108.045 173.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -84.47 140.49 31.45 Favored 'General case' 0 C--O 1.273 2.318 0 CA-C-N 115.807 -0.633 . . . . 42.56 109.851 170.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 52.1 mt -115.15 141.26 48.26 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-O 122.587 1.184 . . . . 44.15 112.077 -170.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -82.58 85.87 6.91 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 114.382 -1.281 . . . . 52.46 108.78 172.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -163.39 142.4 8.27 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.57 0.7 . . . . 93.03 110.326 176.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' GLY . . . . . . . . . . . . . . . 64.78 -135.17 38.02 Favored Glycine 0 C--O 1.209 -1.423 0 CA-C-N 115.813 -0.631 . . . . 59.36 111.62 163.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 55.5 p-10 -80.72 -0.47 38.52 Favored 'General case' 0 C--O 1.215 -0.732 0 C-N-CA 122.95 0.5 . . . . 54.66 110.503 -176.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' GLY . . . . . . . . . . . . . . . 87.89 9.51 71.03 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-O 118.451 -1.194 . . . . 47.47 111.405 169.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -103.85 15.05 29.58 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-O 121.932 0.872 . . . . 98.03 111.453 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -88.9 137.33 32.42 Favored 'General case' 0 N--CA 1.433 -1.293 0 O-C-N 120.976 -1.078 . . . . 64.69 109.649 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -137.35 170.55 17.58 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 121.632 0.73 . . . . 46.93 109.41 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.81 144.99 51.32 Favored 'General case' 0 N--CA 1.41 -2.457 0 N-CA-C 106.915 -1.513 . . . . 47.22 106.915 174.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -140.92 145.44 36.09 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 109.324 -0.621 . . . . 50.97 109.324 -175.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' TRP . . . . . . . . . . . . . 40.8 p90 -147.61 157.34 43.51 Favored 'General case' 0 C--O 1.213 -0.837 0 O-C-N 124.712 1.258 . . . . 43.08 109.347 171.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -70.66 146.04 50.22 Favored 'General case' 0 C--O 1.194 -1.828 0 C-N-CA 124.355 1.062 . . . . 61.35 109.24 177.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' THR . . . . . . . . . . . . . 33.5 p -143.45 151.27 40.15 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 108.125 -1.065 . . . . 55.16 108.125 173.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.18 140.48 47.03 Favored 'General case' 0 C--O 1.249 1.032 0 N-CA-C 107.181 -1.415 . . . . 57.34 107.181 160.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 92.6 t -125.66 135.72 63.06 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.592 0 N-CA-C 108.553 -0.906 . . . . 57.21 108.553 176.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -166.44 166.06 16.65 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-O 122.666 1.222 . . . . 61.13 112.816 177.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -89.77 128.96 36.22 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-N 113.267 -1.788 . . . . 58.35 108.796 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 75.1 p -85.34 164.41 17.99 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 118.959 -1.096 . . . . 67.91 110.242 179.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' THR . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.537 0.473 0 CA-C-N 113.082 -1.872 . . . . 100.3 109.367 174.253 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.203 0 CA-C-O 120.468 0.175 . . . . 64.08 111.128 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.03 128.34 22.69 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 123.254 2.636 . . . . 56.64 113.704 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' VAL . . . . . . . . . . . . . 30.1 m -127.63 153.06 77.65 Favored Pre-proline 0 N--CA 1.42 -1.927 0 O-C-N 124.753 1.283 . . . . 49.72 108.075 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -77.17 152.11 30.79 Favored 'Trans proline' 0 C--O 1.246 0.903 0 C-N-CA 121.275 1.317 . . . . 44.46 111.684 -173.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' VAL . . . . . . . . . . . . . 58.5 t -93.03 125.7 45.55 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.536 0 O-C-N 124.712 1.258 . . . . 47.66 108.251 170.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' THR . . . . . . . . . . . . . 40.3 p -86.02 -43.54 13.05 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 109.769 -0.456 . . . . 52.71 109.769 178.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' LYS . . . . . . . . . . . . . 12.7 mttp -142.19 143.88 33.14 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.282 0.563 . . . . 81.68 110.128 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' LEU . . . . . . . . . . . . . 12.9 tp -121.63 137.02 54.92 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.485 1.514 . . . . 51.32 108.786 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' VAL . . . . . . . . . . . . . 20.6 m -140.49 155.42 22.98 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.37 0 N-CA-C 106.839 -1.541 . . . . 42.04 106.839 174.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' CYS . . . . . . . . . . . . . 87.9 m -131.25 152.37 50.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 124.307 1.004 . . . . 46.67 109.926 173.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -134.02 114.07 12.81 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 107.325 -1.361 . . . . 43.29 107.325 -168.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.99 -0.88 89.78 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 115.499 -0.773 . . . . 34.57 112.263 -174.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -98.04 -40.93 8.2 Favored 'General case' 0 C--O 1.212 -0.91 0 C-N-CA 122.834 0.454 . . . . 52.81 110.62 171.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' THR . . . . . . . . . . . . . 80.6 p -88.74 -17.75 29.22 Favored 'General case' 0 C--O 1.2 -1.525 0 C-N-CA 119.688 -0.805 . . . . 36.72 111.926 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 60.88 43.51 11.76 Favored 'General case' 0 C--O 1.212 -0.902 0 N-CA-C 108.149 -1.056 . . . . 36.56 108.149 -174.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -127.02 137.82 53.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-O 122.698 1.237 . . . . 43.23 110.655 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' CYS . . . . . . . . . . . . . 49.4 t -99.88 122.88 43.48 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 113.917 -1.492 . . . . 52.83 109.182 166.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' THR . . . . . . . . . . . . . 77.0 m -107.99 131.72 54.27 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 108.803 -0.814 . . . . 42.5 108.803 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.05 112.71 20.6 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.63 1.172 . . . . 38.34 110.084 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -76.72 135.33 39.04 Favored 'General case' 0 C--O 1.253 1.271 0 N-CA-C 108.682 -0.858 . . . . 46.45 108.682 176.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' LEU . . . . . . . . . . . . . 31.2 mt -108.26 148.09 30.48 Favored 'General case' 0 C--O 1.208 -1.121 0 N-CA-C 108.695 -0.854 . . . . 43.11 108.695 -171.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -92.6 93.07 8.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 115.229 -0.896 . . . . 50.69 109.004 170.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -167.11 144.34 4.64 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-O 122.836 1.303 . . . . 43.02 110.679 -172.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.28 -122.35 7.18 Favored Glycine 0 N--CA 1.415 -2.761 0 CA-C-N 114.075 -1.42 . . . . 35.43 110.194 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' ASP . . . . . . . . . . . . . 38.4 p-10 -93.25 11.82 26.68 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 113.786 -1.207 . . . . 35.47 111.736 -165.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.25 5.35 89.76 Favored Glycine 0 C--N 1.341 0.822 0 C-N-CA 121.112 -0.566 . . . . 38.11 113.962 174.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 3.4 mtmm -113.15 22.35 14.42 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 117.603 0.702 . . . . 56.59 112.244 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -96.06 137.92 34.44 Favored 'General case' 0 C--O 1.265 1.891 0 CA-C-O 122.77 1.271 . . . . 39.34 110.153 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' VAL . . . . . . . . . . . . . 97.1 t -144.3 142.12 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 CA-C-N 114.038 -1.437 . . . . 44.05 107.584 -168.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ALA . . . . . . . . . . . . . . . -114.66 152.53 31.77 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 107.127 -1.435 . . . . 39.27 107.127 172.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -156.71 138.28 14.06 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 117.325 -1.75 . . . . 36.05 108.89 -174.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 32' ' ' TRP . . . . . . . . . . . . . 46.8 p90 -146.67 162.86 37.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.829 -0.749 . . . . 38.23 109.133 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -74.38 150.86 39.85 Favored 'General case' 0 N--CA 1.414 -2.27 0 O-C-N 126.273 2.233 . . . . 42.24 107.715 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 34' ' ' THR . . . . . . . . . . . . . 5.4 t -156.72 150.14 24.36 Favored 'General case' 0 N--CA 1.426 -1.654 0 O-C-N 124.532 1.145 . . . . 38.08 108.488 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.0 146.04 35.62 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 106.982 -1.488 . . . . 36.02 106.982 166.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 36' ' ' VAL . . . . . . . . . . . . . 81.7 t -130.74 131.72 64.5 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 N-CA-C 108.434 -0.95 . . . . 38.24 108.434 168.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 37' ' ' PHE . . . . . 0.506 ' CE1' HG22 ' F' ' 29' ' ' VAL . 20.2 p90 -151.34 165.27 34.58 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 122.564 1.173 . . . . 43.16 112.498 -177.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -109.8 124.8 51.92 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 112.864 -1.971 . . . . 43.92 108.762 -177.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 39' ' ' THR . . . . . 0.48 ' O ' ' CE ' ' F' ' 27' ' ' LYS . 38.5 p . . . . . 0 N--CA 1.502 2.162 0 CA-C-N 119.529 1.059 . . . . 60.01 112.675 -167.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 1' ' ' ALA . . . . . 0.575 ' N ' ' OD2' ' F' ' 13' ' ' ASP . . . . . . . . 0 N--CA 1.495 1.798 0 N-CA-C 110.397 -0.223 . . . . 66.4 110.397 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 2' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -63.23 132.76 37.6 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 124.232 3.288 . . . . 63.51 116.401 -174.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 3' ' ' VAL . . . . . . . . . . . . . 18.2 m -134.0 149.49 71.79 Favored Pre-proline 0 N--CA 1.478 0.957 0 O-C-N 124.691 1.244 . . . . 63.25 111.027 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 4' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_exo -60.75 149.64 86.82 Favored 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 123.734 2.956 . . . . 60.07 115.587 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 5' ' ' VAL . . . . . . . . . . . . . 99.5 t -95.52 118.56 42.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 N-CA-C 108.367 -0.975 . . . . 56.07 108.367 167.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 6' ' ' THR . . . . . . . . . . . . . 7.2 m -70.81 -52.42 20.62 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 124.914 1.285 . . . . 69.63 110.288 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -151.51 151.61 31.84 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 106.899 -1.519 . . . . 104.06 106.899 -170.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 8' ' ' LEU . . . . . . . . . . . . . 14.7 tp -127.91 135.09 49.51 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 109.277 -0.638 . . . . 57.41 109.277 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 9' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.73 155.24 30.38 Favored 'Isoleucine or valine' 0 C--O 1.243 0.721 0 N-CA-C 108.755 -0.832 . . . . 51.88 108.755 175.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 10' ' ' CYS . . . . . . . . . . . . . 63.5 m -127.65 155.27 44.17 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 107.781 -1.192 . . . . 52.42 107.781 172.056 -57.091 -37.343 -55.795 140.564 3.098 77.099 82.579 -177.902 1 1 . 1 . 001 ecloud build full ' E' E ' 11' ' ' ASP . . . . . 0.499 ' HB3' HG22 ' E' ' 14' ' ' THR . 32.5 t0 -143.53 118.78 10.18 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 107.48 -1.304 . . . . 53.91 107.48 -167.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.37 -6.45 88.68 Favored Glycine 0 C--O 1.251 1.191 0 O-C-N 123.802 0.689 . . . . 46.9 113.175 -173.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 13' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -84.87 -38.07 19.89 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 107.705 -1.22 . . . . 59.95 107.705 175.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 14' ' ' THR . . . . . 0.499 HG22 ' HB3' ' E' ' 11' ' ' ASP . 9.2 t -98.76 -15.35 19.34 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-O 117.724 -1.132 . . . . 66.77 111.841 -174.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 15' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 54.98 45.96 25.32 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 125.057 1.343 . . . . 52.51 111.565 -172.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 16' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -133.34 136.19 45.23 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.31 1.444 . . . . 55.09 110.6 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 17' ' ' CYS . . . . . 0.685 ' SG ' HG21 ' E' ' 34' ' ' THR . 50.1 t -100.63 139.24 36.58 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 113.463 -1.698 . . . . 54.24 108.245 166.734 -177.902 82.579 -55.795 77.099 3.098 140.564 -37.343 -57.091 2 2 . 1 . 001 ecloud build full ' E' E ' 18' ' ' THR . . . . . . . . . . . . . 52.0 m -127.19 125.3 40.83 Favored 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 107.375 -1.343 . . . . 47.35 107.375 -174.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.76 123.24 47.63 Favored 'General case' 0 C--O 1.221 -0.413 0 O-C-N 123.838 0.711 . . . . 51.08 110.431 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 20' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -84.1 125.19 31.89 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.523 -0.917 . . . . 67.05 108.523 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.43 147.54 25.16 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.839 0.856 . . . . 68.81 111.71 -171.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 22' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -92.11 84.62 5.3 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.49 -0.777 . . . . 75.38 110.101 168.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 23' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -162.03 145.61 12.09 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.679 0.792 . . . . 68.38 111.055 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.63 -128.84 47.66 Favored Glycine 0 C--N 1.341 0.829 0 CA-C-N 114.644 -1.162 . . . . 69.96 112.675 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -73.81 -3.5 29.04 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.351 1.06 . . . . 88.61 113.32 176.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.71 20.51 79.71 Favored Glycine 0 N--CA 1.489 2.18 0 CA-C-N 119.276 0.944 . . . . 80.01 113.411 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 27' ' ' LYS . . . . . . . . . . . . . 10.9 mmpt? -105.54 19.77 20.01 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.736 -0.838 . . . . 95.55 108.736 175.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 28' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -97.32 138.46 34.76 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.016 -0.674 . . . . 77.71 109.464 -175.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 29' ' ' VAL . . . . . . . . . . . . . 19.6 m -133.95 167.87 25.25 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.931 0 CA-C-O 122.467 1.127 . . . . 49.87 109.861 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.59 137.34 51.65 Favored 'General case' 0 C--O 1.203 -1.348 0 CA-C-N 113.211 -1.813 . . . . 48.0 106.897 172.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 31' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -147.7 160.06 43.11 Favored 'General case' 0 C--O 1.208 -1.12 0 C-N-CA 116.665 -2.014 . . . . 55.63 113.225 172.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 32' ' ' TRP . . . . . . . . . . . . . 49.0 p90 -152.8 159.26 43.07 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 112.605 -2.089 . . . . 44.93 108.333 -171.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 33' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -70.41 153.34 43.09 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 114.803 -1.089 . . . . 65.27 110.171 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 34' ' ' THR . . . . . 0.685 HG21 ' SG ' ' E' ' 17' ' ' CYS . 5.9 t -157.31 148.17 21.48 Favored 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 107.753 -1.203 . . . . 45.47 107.753 176.063 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.16 148.99 49.13 Favored 'General case' 0 N--CA 1.42 -1.937 0 O-C-N 125.32 1.638 . . . . 34.94 109.052 159.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 36' ' ' VAL . . . . . . . . . . . . . 62.6 t -137.84 116.61 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.104 0 N-CA-C 107.005 -1.48 . . . . 40.34 107.005 173.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 37' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -140.6 167.15 22.85 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 123.653 0.596 . . . . 39.2 110.886 -178.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 38' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -111.81 117.55 33.12 Favored 'General case' 0 C--O 1.258 1.514 0 C-N-CA 126.277 1.831 . . . . 46.59 108.804 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 39' ' ' THR . . . . . . . . . . . . . 28.4 p -76.73 148.54 36.67 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 123.405 1.574 . . . . 58.12 108.473 177.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 40' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.427 -1.616 0 CA-C-O 116.378 -1.772 . . . . 91.86 109.565 -168.676 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 108.483 -0.932 . . . . 47.49 108.483 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 2' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -69.39 138.97 40.32 Favored 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 121.796 1.664 . . . . 53.42 109.019 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 3' ' ' VAL . . . . . . . . . . . . . 31.5 m -129.95 155.59 80.37 Favored Pre-proline 0 N--CA 1.411 -2.39 0 N-CA-C 107.683 -1.229 . . . . 44.24 107.683 173.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 4' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -62.31 151.18 84.0 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.913 2.409 . . . . 46.24 112.763 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 5' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.35 128.01 45.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 O-C-N 125.984 2.053 . . . . 52.43 109.524 170.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -83.09 -51.68 7.31 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.282 -1.326 . . . . 65.87 108.592 -176.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 7' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -147.93 149.23 31.82 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.339 -0.846 . . . . 94.89 109.217 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 8' ' ' LEU . . . . . 0.444 HD11 ' SG ' ' F' ' 17' ' ' CYS . 26.3 tp -130.53 130.16 43.77 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 124.274 1.03 . . . . 53.92 109.844 -178.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 9' ' ' VAL . . . . . . . . . . . . . 10.4 m -142.27 155.2 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 108.246 -1.02 . . . . 48.54 108.246 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 10' ' ' CYS . . . . . . . . . . . . . 57.9 m -128.74 173.65 10.14 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.709 -0.478 . . . . 59.27 109.709 172.955 -54.532 -99.884 104.151 105.843 2.036 106.393 -83.649 -63.361 1 1 . 1 . 001 ecloud build full ' F' F ' 11' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -157.93 119.51 3.6 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 123.345 0.403 . . . . 55.9 111.339 -172.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 12' ' ' GLY . . . . . . . . . . . . . . . -81.18 -10.89 84.22 Favored Glycine 0 C--O 1.249 1.04 0 CA-C-N 115.491 -0.777 . . . . 51.03 113.974 -174.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 13' ' ' ASP . . . . . 0.575 ' OD2' ' N ' ' E' ' 1' ' ' ALA . 21.3 m-20 -82.4 -32.89 28.89 Favored 'General case' 0 C--O 1.251 1.178 0 C-N-CA 119.808 -0.757 . . . . 55.88 109.755 170.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 14' ' ' THR . . . . . . . . . . . . . 29.6 p -100.85 -22.14 14.92 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 118.966 -0.54 . . . . 41.22 112.063 -173.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 15' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 62.49 43.55 7.77 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.541 1.136 . . . . 88.31 108.092 -179.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 16' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -137.44 137.13 38.43 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.097 -0.956 . . . . 46.84 109.421 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 17' ' ' CYS . . . . . 0.444 ' SG ' HD11 ' F' ' 8' ' ' LEU . 74.6 m -102.06 137.02 40.89 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 126.048 2.092 . . . . 52.9 107.642 163.773 -63.361 -83.649 104.151 106.393 2.036 105.843 -99.884 -54.532 2 2 . 1 . 001 ecloud build full ' F' F ' 18' ' ' THR . . . . . . . . . . . . . 44.7 m -123.04 132.63 54.2 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.286 1.434 . . . . 39.1 109.21 -171.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.88 114.68 21.36 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 123.993 0.808 . . . . 41.81 109.542 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 20' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -83.74 140.31 32.19 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 106.165 -1.791 . . . . 48.85 106.165 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 21' ' ' LEU . . . . . . . . . . . . . 85.0 mt -115.71 144.66 43.64 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-O 122.867 1.318 . . . . 45.88 111.086 -166.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 22' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -89.27 95.62 10.37 Favored 'General case' 0 N--CA 1.416 -2.129 0 CA-C-N 113.136 -1.847 . . . . 64.21 107.865 170.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 23' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -169.41 143.84 2.93 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.524 -0.762 . . . . 49.57 108.97 178.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.33 -125.26 35.67 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.286 -0.725 . . . . 52.54 111.286 171.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 39.9 p-10 -90.0 5.42 46.63 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.954 1.302 . . . . 67.34 111.613 -174.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.43 10.89 84.8 Favored Glycine 0 N--CA 1.471 1.024 0 CA-C-N 118.343 0.519 . . . . 51.74 113.607 176.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 27' ' ' LYS . . . . . 0.48 ' CE ' ' O ' ' D' ' 39' ' ' THR . 19.0 mtpt -108.49 14.28 24.78 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.729 -1.454 . . . . 83.85 110.729 -175.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 28' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -91.82 127.61 37.35 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 123.243 0.617 . . . . 49.93 109.958 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 29' ' ' VAL . . . . . 0.506 HG22 ' CE1' ' D' ' 37' ' ' PHE . 1.4 m -129.1 143.64 40.61 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.872 0 CA-C-O 121.436 0.636 . . . . 45.0 109.98 176.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 30' ' ' ALA . . . . . . . . . . . . . . . -99.67 142.42 31.18 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 123.36 0.664 . . . . 40.12 110.223 166.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 31' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -149.53 137.81 20.65 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 122.454 1.121 . . . . 36.45 111.846 -176.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 32' ' ' TRP . . . . . . . . . . . . . 47.6 p90 -146.74 161.27 40.97 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 114.349 -1.296 . . . . 38.52 110.32 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 33' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -71.77 145.74 48.53 Favored 'General case' 0 C--O 1.246 0.906 0 CA-C-N 112.966 -1.924 . . . . 62.04 110.472 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 34' ' ' THR . . . . . . . . . . . . . 15.2 t -150.43 146.94 26.98 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 114.152 -1.386 . . . . 55.69 110.726 -179.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.33 145.48 32.07 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.742 -1.577 . . . . 46.65 106.742 162.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 36' ' ' VAL . . . . . . . . . . . . . 33.2 t -127.91 139.35 52.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 107.34 -1.356 . . . . 61.72 107.34 169.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 37' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -164.69 164.83 21.28 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.84 1.305 . . . . 81.35 111.506 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 38' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -92.74 147.39 22.9 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 113.448 -1.706 . . . . 82.76 108.823 175.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 39' ' ' THR . . . . . . . . . . . . . 55.3 p . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 121.824 0.821 . . . . 82.35 110.587 -177.184 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 101' ' ' NAG . . . . . 0.464 ' H2 ' ' O ' ' D' ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 101' ' ' MEE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 102' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 103' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 104' ' ' MEE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 102' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 103' ' ' MEE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 105' ' ' HOH . . . . . 0.419 ' O ' HG21 ' A' ' 39' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 207' ' ' HOH . . . . . 0.464 ' O ' ' H2 ' ' D' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.515 2.818 0 N-CA-C 110.94 -0.022 . . . . 74.43 110.94 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -94.66 122.72 0.36 Allowed 'Trans proline' 0 C--O 1.192 -1.822 0 C-N-CA 122.712 2.275 . . . . 64.44 107.087 167.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.9 t -108.14 118.66 52.02 Favored Pre-proline 0 N--CA 1.437 -1.113 0 CA-C-O 121.06 0.457 . . . . 52.64 110.28 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -67.74 143.1 60.34 Favored 'Trans proline' 0 C--O 1.208 -1.007 0 C-N-CA 121.395 1.397 . . . . 38.61 112.755 -175.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 43.9 t -94.85 132.66 38.21 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.438 0 C-N-CA 124.39 1.076 . . . . 43.32 109.926 171.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -94.21 -45.05 7.69 Favored 'General case' 0 N--CA 1.435 -1.208 0 C-N-CA 127.854 2.462 . . . . 47.6 107.87 -168.263 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.7 pttt -168.08 171.18 9.78 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 108.799 -0.815 . . . . 61.83 108.799 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 19' ' ' ALA . 72.8 mt -129.25 149.81 50.89 Favored 'General case' 0 C--O 1.215 -0.714 0 O-C-N 124.513 1.133 . . . . 55.15 111.624 179.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 23.1 m -135.62 160.39 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.704 0 CA-C-N 114.272 -1.331 . . . . 47.09 107.966 166.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 38.7 m -131.23 148.39 52.69 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 124.753 1.283 . . . . 60.38 109.695 170.384 -52.208 -104.822 103.583 106.966 2.042 107.742 -78.874 -70.103 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -127.96 117.21 21.32 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 113.514 -1.676 . . . . 54.19 108.554 -172.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.92 -16.37 80.84 Favored Glycine 0 N--CA 1.474 1.176 0 O-C-N 123.569 0.543 . . . . 61.92 113.614 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -75.51 -49.24 19.32 Favored 'General case' 0 C--O 1.221 -0.447 0 N-CA-C 107.895 -1.15 . . . . 57.48 107.895 174.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 33.8 p -88.64 -17.49 29.94 Favored 'General case' 0 C--O 1.212 -0.911 0 O-C-N 124.225 0.953 . . . . 51.52 111.699 -173.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 57.29 40.51 27.72 Favored 'General case' 0 C--O 1.217 -0.627 0 O-C-N 121.557 -0.714 . . . . 69.59 109.903 -173.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -120.96 139.49 53.18 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.115 0.966 . . . . 57.39 110.298 173.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.407 ' SG ' HG21 ' A' ' 34' ' ' THR . 92.1 m -97.56 139.33 33.63 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 107.581 -1.266 . . . . 57.4 107.581 163.018 -70.103 -78.874 103.583 107.742 2.042 106.966 -104.822 -52.208 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 56.8 m -129.98 125.54 35.64 Favored 'General case' 0 N--CA 1.423 -1.777 0 CA-C-N 114.706 -1.133 . . . . 40.82 108.267 -173.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.411 ' HA ' HD23 ' A' ' 8' ' ' LEU . . . -103.49 126.83 50.87 Favored 'General case' 0 N--CA 1.438 -1.025 0 O-C-N 124.082 0.864 . . . . 40.49 110.488 175.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -83.14 139.86 32.94 Favored 'General case' 0 N--CA 1.424 -1.736 0 N-CA-C 107.388 -1.338 . . . . 53.74 107.388 174.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 43.8 mt -110.67 145.62 37.63 Favored 'General case' 0 N--CA 1.438 -1.064 0 O-C-N 125.038 1.461 . . . . 43.78 112.005 -174.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -85.46 92.8 8.6 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.013 -0.994 . . . . 53.64 109.73 167.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -170.6 138.51 1.47 Allowed 'General case' 0 C--O 1.248 1.023 0 O-C-N 122.009 -0.432 . . . . 46.69 110.415 -170.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.41 -124.28 32.74 Favored Glycine 0 C--O 1.243 0.685 0 C-N-CA 124.857 1.218 . . . . 43.93 111.865 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 37.3 p-10 -83.67 4.02 30.45 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 114.421 -0.889 . . . . 47.38 112.438 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 84.59 8.2 83.36 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-O 118.458 -1.19 . . . . 42.85 114.855 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -118.18 16.71 14.05 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 119.562 1.681 . . . . 65.4 112.948 -176.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -86.25 141.02 29.59 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.454 -0.572 . . . . 41.84 109.454 171.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.2 m -131.61 164.54 34.22 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.936 0 CA-C-O 122.846 1.308 . . . . 40.87 110.772 170.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -119.08 139.33 51.93 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 114.078 -1.419 . . . . 38.77 108.193 169.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -135.08 142.88 46.39 Favored 'General case' 0 C--O 1.211 -0.943 0 O-C-N 123.75 0.656 . . . . 48.06 111.051 -168.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -152.86 157.21 40.37 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 122.289 1.043 . . . . 46.27 110.008 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 -67.03 139.95 57.66 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 112.991 -1.913 . . . . 55.8 108.669 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . 0.407 HG21 ' SG ' ' A' ' 17' ' ' CYS . 8.8 t -143.37 156.68 44.74 Favored 'General case' 0 N--CA 1.424 -1.766 0 CA-C-N 115.333 -0.849 . . . . 50.14 109.658 175.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -88.27 150.11 23.44 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 107.836 -1.172 . . . . 50.11 107.836 162.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.6 t -140.1 135.43 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 106.914 -1.513 . . . . 60.19 106.914 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -170.09 156.11 5.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 123.691 0.62 . . . . 58.18 111.246 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -76.1 125.92 30.04 Favored 'General case' 0 C--O 1.21 -1.001 0 CA-C-N 113.498 -1.683 . . . . 72.46 107.753 172.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . 0.419 HG21 ' O ' ' C' ' 105' ' ' HOH . 2.3 t -90.5 176.23 6.78 Favored 'General case' 0 N--CA 1.425 -1.719 0 C-N-CA 119.146 -1.022 . . . . 75.48 110.166 179.11 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.7 t . . . . . 0 CA--C 1.542 0.653 0 CA-C-N 113.813 -1.54 . . . . 102.28 109.335 168.926 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.988 0 CA-C-O 121.634 0.73 . . . . 72.8 109.634 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -80.01 144.86 17.16 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 121.16 1.24 . . . . 64.9 109.715 -165.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' VAL . . . . . . . . . . . . . 35.0 m -122.86 155.34 63.74 Favored Pre-proline 0 N--CA 1.427 -1.614 0 N-CA-C 108.368 -0.975 . . . . 49.71 108.368 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -62.56 145.86 95.38 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.212 1.275 . . . . 42.76 113.015 178.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 55.8 t -91.59 124.03 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 CA-C-N 114.937 -1.029 . . . . 41.57 109.359 163.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.69 -41.64 16.08 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 125.813 1.645 . . . . 58.47 110.171 -176.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -161.78 164.59 28.82 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 122.527 1.156 . . . . 64.45 113.81 171.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 20.2 mt -119.14 139.02 52.51 Favored 'General case' 0 N--CA 1.426 -1.668 0 CA-C-N 112.612 -2.085 . . . . 53.0 110.732 173.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 1.5 t -136.35 162.51 35.54 Favored 'Isoleucine or valine' 0 N--CA 1.38 -3.974 0 N-CA-C 104.38 -2.452 . . . . 49.87 104.38 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 7.1 t -144.82 128.78 17.47 Favored 'General case' 0 N--CA 1.417 -2.116 0 N-CA-C 107.682 -1.229 . . . . 59.17 107.682 -172.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -80.42 137.43 36.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 119.49 -0.884 . . . . 56.52 108.774 -176.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -68.36 -25.3 74.8 Favored Glycine 0 N--CA 1.489 2.178 0 C-N-CA 125.313 1.435 . . . . 46.71 115.416 -175.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -103.68 -46.14 4.61 Favored 'General case' 0 C--O 1.195 -1.782 0 CA-C-O 117.906 -1.045 . . . . 43.18 110.377 -171.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 65.0 p -88.06 -21.52 24.7 Favored 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 113.561 0.949 . . . . 42.37 113.561 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' TYR . . . . . . . . . . . . . 16.1 m-30 57.92 29.7 18.02 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 109.672 -0.492 . . . . 44.08 109.672 -168.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -76.57 132.73 39.66 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 107.745 -1.205 . . . . 84.0 107.745 169.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' CYS . . . . . . . . . . . . . 5.0 t -100.88 125.37 47.42 Favored 'General case' 0 N--CA 1.412 -2.35 0 CA-C-O 118.411 -0.804 . . . . 57.72 110.253 -179.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 57.5 m -116.26 123.42 47.67 Favored 'General case' 0 N--CA 1.483 1.225 0 O-C-N 123.932 0.77 . . . . 42.85 112.028 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.27 118.14 36.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.404 1.482 . . . . 40.96 110.563 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -85.14 122.61 29.58 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.255 1.022 . . . . 58.19 109.469 177.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 21.9 mt -92.67 135.75 33.82 Favored 'General case' 0 C--O 1.2 -1.506 0 O-C-N 123.585 0.553 . . . . 42.47 111.596 -173.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -81.75 94.82 7.09 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.022 -1.103 . . . . 55.38 108.022 169.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -167.09 138.98 3.31 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 123.631 0.772 . . . . 47.57 111.027 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 49.6 -121.05 8.43 Favored Glycine 0 C--N 1.345 1.078 0 O-C-N 123.71 0.631 . . . . 45.09 111.897 171.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 55.6 p30 -81.72 -3.28 53.3 Favored 'General case' 0 N--CA 1.487 1.41 0 CA-C-O 119.028 -0.511 . . . . 50.3 111.241 -171.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.76 11.29 79.78 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 120.035 -0.314 . . . . 49.15 113.251 173.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -113.85 8.32 17.29 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 117.9 0.85 . . . . 81.56 110.531 -171.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -80.09 140.97 36.23 Favored 'General case' 0 N--CA 1.42 -1.946 0 CA-C-O 118.715 -0.66 . . . . 54.88 110.422 173.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 35.2 m -136.18 164.13 32.42 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 O-C-N 125.085 1.491 . . . . 49.99 110.931 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -121.77 149.45 43.28 Favored 'General case' 0 C--O 1.257 1.452 0 CA-C-N 114.021 -1.445 . . . . 46.14 107.365 170.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -146.59 144.46 29.56 Favored 'General case' 0 N--CA 1.422 -1.83 0 C-N-CA 119.461 -0.896 . . . . 64.24 110.828 -172.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' TRP . . . . . . . . . . . . . 46.8 p90 -157.37 165.46 35.7 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-N 114.532 -1.213 . . . . 47.42 110.691 171.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -88.85 151.92 22.06 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 113.272 -1.786 . . . . 48.18 109.082 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 5.9 p -146.58 166.95 24.96 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 113.515 -1.675 . . . . 38.95 109.965 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -108.19 128.77 55.0 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 113.654 -1.612 . . . . 47.83 108.658 168.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 44.6 t -109.32 138.24 37.6 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.819 0 CA-C-N 114.737 -1.12 . . . . 49.97 109.612 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' PHE . . . . . . . . . . . . . 42.5 p90 -160.53 167.45 27.14 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 123.506 1.622 . . . . 52.58 111.963 177.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -98.63 132.41 44.05 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 112.924 -1.944 . . . . 53.77 109.238 -174.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 18.9 p -104.88 176.19 5.24 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.261 1.029 . . . . 53.32 111.9 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.239 0.509 0 CA-C-N 113.829 -1.532 . . . . 79.75 109.218 164.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 109.851 -0.425 . . . . 69.3 109.851 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -66.47 128.13 18.62 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 N-CA-C 105.931 -2.373 . . . . 59.5 105.931 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 33.3 m -124.34 148.27 57.61 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 107.485 -1.302 . . . . 47.84 107.485 169.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -61.84 143.84 96.24 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 122.493 2.129 . . . . 41.65 112.145 -174.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' VAL . . . . . . . . . . . . . 90.9 t -87.74 127.56 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 N-CA-C 107.302 -1.37 . . . . 44.93 107.302 164.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' THR . . . . . . . . . . . . . 58.1 p -98.05 -24.58 15.27 Favored 'General case' 0 C--O 1.241 0.654 0 O-C-N 124.323 1.015 . . . . 42.8 110.871 -173.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 24.8 tttm -159.86 145.77 15.73 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 115.441 -0.8 . . . . 80.8 109.288 -174.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' LEU . . . . . . . . . . . . . 25.1 tp -135.16 124.64 24.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.292 -0.867 . . . . 46.86 109.758 -176.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 20.2 m -128.16 159.23 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 108.355 -0.98 . . . . 44.21 108.355 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' CYS . . . . . . . . . . . . . 50.7 t -129.22 138.51 51.73 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 124.753 1.283 . . . . 47.42 109.791 174.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ASP . . . . . 0.639 ' HB3' HG22 ' C' ' 14' ' ' THR . 42.3 t0 -110.77 113.74 26.57 Favored 'General case' 0 C--O 1.247 0.961 0 CA-C-O 121.288 0.566 . . . . 57.26 109.914 179.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.03 -47.47 72.9 Favored Glycine 0 C--O 1.247 0.923 0 C-N-CA 125.15 1.357 . . . . 64.95 113.853 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.37 -30.22 37.9 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-O 118.681 -0.676 . . . . 88.75 110.704 -173.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' THR . . . . . 0.639 HG22 ' HB3' ' C' ' 11' ' ' ASP . 5.1 t -87.8 -15.88 35.66 Favored 'General case' 0 C--O 1.203 -1.371 0 C-N-CA 118.136 -1.425 . . . . 71.48 112.348 175.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' TYR . . . . . . . . . . . . . 71.6 m-85 61.49 45.43 8.36 Favored 'General case' 0 N--CA 1.493 1.678 0 CA-C-N 120.455 1.48 . . . . 78.39 110.518 -176.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -137.93 133.39 33.7 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 116.152 -0.476 . . . . 65.81 109.943 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' CYS . . . . . . . . . . . . . 22.3 m -88.09 139.84 30.1 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 124.926 1.391 . . . . 56.98 109.56 164.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' THR . . . . . . . . . . . . . 65.7 m -122.25 123.31 41.15 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 115.052 -0.976 . . . . 45.41 109.301 172.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ALA . . . . . . . . . . . . . . . -102.67 125.07 49.26 Favored 'General case' 0 N--CA 1.432 -1.351 0 C-N-CA 124.444 1.097 . . . . 38.6 108.045 173.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -84.47 140.49 31.45 Favored 'General case' 0 C--O 1.273 2.318 0 CA-C-N 115.807 -0.633 . . . . 42.56 109.851 170.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 52.1 mt -115.15 141.26 48.26 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-O 122.587 1.184 . . . . 44.15 112.077 -170.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -82.58 85.87 6.91 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 114.382 -1.281 . . . . 52.46 108.78 172.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -163.39 142.4 8.27 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.57 0.7 . . . . 93.03 110.326 176.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' GLY . . . . . . . . . . . . . . . 64.78 -135.17 38.02 Favored Glycine 0 C--O 1.209 -1.423 0 CA-C-N 115.813 -0.631 . . . . 59.36 111.62 163.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ASP . . . . . . . . . . . . . 55.5 p-10 -80.72 -0.47 38.52 Favored 'General case' 0 C--O 1.215 -0.732 0 C-N-CA 122.95 0.5 . . . . 54.66 110.503 -176.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' GLY . . . . . . . . . . . . . . . 87.89 9.51 71.03 Favored Glycine 0 N--CA 1.446 -0.691 0 CA-C-O 118.451 -1.194 . . . . 47.47 111.405 169.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -103.85 15.05 29.58 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-O 121.932 0.872 . . . . 98.03 111.453 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -88.9 137.33 32.42 Favored 'General case' 0 N--CA 1.433 -1.293 0 O-C-N 120.976 -1.078 . . . . 64.69 109.649 176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' VAL . . . . . . . . . . . . . 19.0 m -137.35 170.55 17.58 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 121.632 0.73 . . . . 46.93 109.41 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.81 144.99 51.32 Favored 'General case' 0 N--CA 1.41 -2.457 0 N-CA-C 106.915 -1.513 . . . . 47.22 106.915 174.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -140.92 145.44 36.09 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 109.324 -0.621 . . . . 50.97 109.324 -175.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' TRP . . . . . . . . . . . . . 40.8 p90 -147.61 157.34 43.51 Favored 'General case' 0 C--O 1.213 -0.837 0 O-C-N 124.712 1.258 . . . . 43.08 109.347 171.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -70.66 146.04 50.22 Favored 'General case' 0 C--O 1.194 -1.828 0 C-N-CA 124.355 1.062 . . . . 61.35 109.24 177.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' THR . . . . . . . . . . . . . 33.5 p -143.45 151.27 40.15 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 108.125 -1.065 . . . . 55.16 108.125 173.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.18 140.48 47.03 Favored 'General case' 0 C--O 1.249 1.032 0 N-CA-C 107.181 -1.415 . . . . 57.34 107.181 160.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' VAL . . . . . . . . . . . . . 92.6 t -125.66 135.72 63.06 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.592 0 N-CA-C 108.553 -0.906 . . . . 57.21 108.553 176.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -166.44 166.06 16.65 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-O 122.666 1.222 . . . . 61.13 112.816 177.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -89.77 128.96 36.22 Favored 'General case' 0 N--CA 1.418 -2.063 0 CA-C-N 113.267 -1.788 . . . . 58.35 108.796 178.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 75.1 p -85.34 164.41 17.99 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 118.959 -1.096 . . . . 67.91 110.242 179.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' THR . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.537 0.473 0 CA-C-N 113.082 -1.872 . . . . 100.3 109.367 174.253 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.203 0 CA-C-O 120.468 0.175 . . . . 64.08 111.128 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.03 128.34 22.69 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 123.254 2.636 . . . . 56.64 113.704 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' VAL . . . . . . . . . . . . . 30.1 m -127.63 153.06 77.65 Favored Pre-proline 0 N--CA 1.42 -1.927 0 O-C-N 124.753 1.283 . . . . 49.72 108.075 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -77.17 152.11 30.79 Favored 'Trans proline' 0 C--O 1.246 0.903 0 C-N-CA 121.275 1.317 . . . . 44.46 111.684 -173.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' VAL . . . . . . . . . . . . . 58.5 t -93.03 125.7 45.55 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.536 0 O-C-N 124.712 1.258 . . . . 47.66 108.251 170.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' THR . . . . . . . . . . . . . 40.3 p -86.02 -43.54 13.05 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 109.769 -0.456 . . . . 52.71 109.769 178.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' LYS . . . . . . . . . . . . . 12.7 mttp -142.19 143.88 33.14 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-O 121.282 0.563 . . . . 81.68 110.128 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' LEU . . . . . . . . . . . . . 12.9 tp -121.63 137.02 54.92 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.485 1.514 . . . . 51.32 108.786 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' VAL . . . . . . . . . . . . . 20.6 m -140.49 155.42 22.98 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.37 0 N-CA-C 106.839 -1.541 . . . . 42.04 106.839 174.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' CYS . . . . . . . . . . . . . 87.9 m -131.25 152.37 50.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 124.307 1.004 . . . . 46.67 109.926 173.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -134.02 114.07 12.81 Favored 'General case' 0 N--CA 1.437 -1.123 0 N-CA-C 107.325 -1.361 . . . . 43.29 107.325 -168.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.99 -0.88 89.78 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 115.499 -0.773 . . . . 34.57 112.263 -174.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -98.04 -40.93 8.2 Favored 'General case' 0 C--O 1.212 -0.91 0 C-N-CA 122.834 0.454 . . . . 52.81 110.62 171.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' THR . . . . . . . . . . . . . 80.6 p -88.74 -17.75 29.22 Favored 'General case' 0 C--O 1.2 -1.525 0 C-N-CA 119.688 -0.805 . . . . 36.72 111.926 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 60.88 43.51 11.76 Favored 'General case' 0 C--O 1.212 -0.902 0 N-CA-C 108.149 -1.056 . . . . 36.56 108.149 -174.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -127.02 137.82 53.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-O 122.698 1.237 . . . . 43.23 110.655 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' CYS . . . . . . . . . . . . . 49.4 t -99.88 122.88 43.48 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 113.917 -1.492 . . . . 52.83 109.182 166.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' THR . . . . . . . . . . . . . 77.0 m -107.99 131.72 54.27 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 108.803 -0.814 . . . . 42.5 108.803 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.05 112.71 20.6 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.63 1.172 . . . . 38.34 110.084 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -76.72 135.33 39.04 Favored 'General case' 0 C--O 1.253 1.271 0 N-CA-C 108.682 -0.858 . . . . 46.45 108.682 176.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' LEU . . . . . . . . . . . . . 31.2 mt -108.26 148.09 30.48 Favored 'General case' 0 C--O 1.208 -1.121 0 N-CA-C 108.695 -0.854 . . . . 43.11 108.695 -171.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -92.6 93.07 8.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 115.229 -0.896 . . . . 50.69 109.004 170.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -167.11 144.34 4.64 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-O 122.836 1.303 . . . . 43.02 110.679 -172.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.28 -122.35 7.18 Favored Glycine 0 N--CA 1.415 -2.761 0 CA-C-N 114.075 -1.42 . . . . 35.43 110.194 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' ASP . . . . . . . . . . . . . 38.4 p-10 -93.25 11.82 26.68 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 113.786 -1.207 . . . . 35.47 111.736 -165.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.25 5.35 89.76 Favored Glycine 0 C--N 1.341 0.822 0 C-N-CA 121.112 -0.566 . . . . 38.11 113.962 174.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 3.4 mtmm -113.15 22.35 14.42 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 117.603 0.702 . . . . 56.59 112.244 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -96.06 137.92 34.44 Favored 'General case' 0 C--O 1.265 1.891 0 CA-C-O 122.77 1.271 . . . . 39.34 110.153 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' VAL . . . . . . . . . . . . . 97.1 t -144.3 142.12 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 CA-C-N 114.038 -1.437 . . . . 44.05 107.584 -168.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ALA . . . . . . . . . . . . . . . -114.66 152.53 31.77 Favored 'General case' 0 N--CA 1.434 -1.249 0 N-CA-C 107.127 -1.435 . . . . 39.27 107.127 172.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -156.71 138.28 14.06 Favored 'General case' 0 N--CA 1.436 -1.151 0 C-N-CA 117.325 -1.75 . . . . 36.05 108.89 -174.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' TRP . . . . . . . . . . . . . 46.8 p90 -146.67 162.86 37.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.829 -0.749 . . . . 38.23 109.133 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -74.38 150.86 39.85 Favored 'General case' 0 N--CA 1.414 -2.27 0 O-C-N 126.273 2.233 . . . . 42.24 107.715 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' THR . . . . . . . . . . . . . 5.4 t -156.72 150.14 24.36 Favored 'General case' 0 N--CA 1.426 -1.654 0 O-C-N 124.532 1.145 . . . . 38.08 108.488 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.0 146.04 35.62 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 106.982 -1.488 . . . . 36.02 106.982 166.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' VAL . . . . . . . . . . . . . 81.7 t -130.74 131.72 64.5 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 N-CA-C 108.434 -0.95 . . . . 38.24 108.434 168.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' PHE . . . . . 0.506 ' CE1' HG22 ' F' ' 29' ' ' VAL . 20.2 p90 -151.34 165.27 34.58 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 122.564 1.173 . . . . 43.16 112.498 -177.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -109.8 124.8 51.92 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 112.864 -1.971 . . . . 43.92 108.762 -177.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' THR . . . . . 0.48 ' O ' ' CE ' ' F' ' 27' ' ' LYS . 38.5 p . . . . . 0 N--CA 1.502 2.162 0 CA-C-N 119.529 1.059 . . . . 60.01 112.675 -167.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 1' ' ' ALA . . . . . 0.575 ' N ' ' OD2' ' F' ' 13' ' ' ASP . . . . . . . . 0 N--CA 1.495 1.798 0 N-CA-C 110.397 -0.223 . . . . 66.4 110.397 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 2' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -63.23 132.76 37.6 Favored 'Trans proline' 0 C--N 1.36 1.145 0 C-N-CA 124.232 3.288 . . . . 63.51 116.401 -174.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' VAL . . . . . . . . . . . . . 18.2 m -134.0 149.49 71.79 Favored Pre-proline 0 N--CA 1.478 0.957 0 O-C-N 124.691 1.244 . . . . 63.25 111.027 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_exo -60.75 149.64 86.82 Favored 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 123.734 2.956 . . . . 60.07 115.587 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' VAL . . . . . . . . . . . . . 99.5 t -95.52 118.56 42.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 N-CA-C 108.367 -0.975 . . . . 56.07 108.367 167.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' THR . . . . . . . . . . . . . 7.2 m -70.81 -52.42 20.62 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 124.914 1.285 . . . . 69.63 110.288 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -151.51 151.61 31.84 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 106.899 -1.519 . . . . 104.06 106.899 -170.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' LEU . . . . . . . . . . . . . 14.7 tp -127.91 135.09 49.51 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 109.277 -0.638 . . . . 57.41 109.277 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 9' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.73 155.24 30.38 Favored 'Isoleucine or valine' 0 C--O 1.243 0.721 0 N-CA-C 108.755 -0.832 . . . . 51.88 108.755 175.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 10' ' ' CYS . . . . . . . . . . . . . 63.5 m -127.65 155.27 44.17 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 107.781 -1.192 . . . . 52.42 107.781 172.056 -57.091 -37.343 -55.795 140.564 3.098 77.099 82.579 -177.902 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 11' ' ' ASP . . . . . 0.499 ' HB3' HG22 ' E' ' 14' ' ' THR . 32.5 t0 -143.53 118.78 10.18 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 107.48 -1.304 . . . . 53.91 107.48 -167.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.37 -6.45 88.68 Favored Glycine 0 C--O 1.251 1.191 0 O-C-N 123.802 0.689 . . . . 46.9 113.175 -173.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 13' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -84.87 -38.07 19.89 Favored 'General case' 0 C--O 1.225 -0.209 0 N-CA-C 107.705 -1.22 . . . . 59.95 107.705 175.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 14' ' ' THR . . . . . 0.499 HG22 ' HB3' ' E' ' 11' ' ' ASP . 9.2 t -98.76 -15.35 19.34 Favored 'General case' 0 N--CA 1.423 -1.824 0 CA-C-O 117.724 -1.132 . . . . 66.77 111.841 -174.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 15' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 54.98 45.96 25.32 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 125.057 1.343 . . . . 52.51 111.565 -172.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 16' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -133.34 136.19 45.23 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.31 1.444 . . . . 55.09 110.6 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 17' ' ' CYS . . . . . 0.685 ' SG ' HG21 ' E' ' 34' ' ' THR . 50.1 t -100.63 139.24 36.58 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 113.463 -1.698 . . . . 54.24 108.245 166.734 -177.902 82.579 -55.795 77.099 3.098 140.564 -37.343 -57.091 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 18' ' ' THR . . . . . . . . . . . . . 52.0 m -127.19 125.3 40.83 Favored 'General case' 0 N--CA 1.432 -1.357 0 N-CA-C 107.375 -1.343 . . . . 47.35 107.375 -174.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.76 123.24 47.63 Favored 'General case' 0 C--O 1.221 -0.413 0 O-C-N 123.838 0.711 . . . . 51.08 110.431 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 20' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -84.1 125.19 31.89 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 108.523 -0.917 . . . . 67.05 108.523 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.43 147.54 25.16 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.839 0.856 . . . . 68.81 111.71 -171.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' ASP . . . . . . . . . . . . . 55.4 t0 -92.11 84.62 5.3 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.49 -0.777 . . . . 75.38 110.101 168.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -162.03 145.61 12.09 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.679 0.792 . . . . 68.38 111.055 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' GLY . . . . . . . . . . . . . . . 56.63 -128.84 47.66 Favored Glycine 0 C--N 1.341 0.829 0 CA-C-N 114.644 -1.162 . . . . 69.96 112.675 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' ASP . . . . . . . . . . . . . 10.3 p30 -73.81 -3.5 29.04 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.351 1.06 . . . . 88.61 113.32 176.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.71 20.51 79.71 Favored Glycine 0 N--CA 1.489 2.18 0 CA-C-N 119.276 0.944 . . . . 80.01 113.411 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 27' ' ' LYS . . . . . . . . . . . . . 10.9 mmpt? -105.54 19.77 20.01 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.736 -0.838 . . . . 95.55 108.736 175.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 28' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -97.32 138.46 34.76 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.016 -0.674 . . . . 77.71 109.464 -175.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 29' ' ' VAL . . . . . . . . . . . . . 19.6 m -133.95 167.87 25.25 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.931 0 CA-C-O 122.467 1.127 . . . . 49.87 109.861 175.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 30' ' ' ALA . . . . . . . . . . . . . . . -128.59 137.34 51.65 Favored 'General case' 0 C--O 1.203 -1.348 0 CA-C-N 113.211 -1.813 . . . . 48.0 106.897 172.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 31' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -147.7 160.06 43.11 Favored 'General case' 0 C--O 1.208 -1.12 0 C-N-CA 116.665 -2.014 . . . . 55.63 113.225 172.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 32' ' ' TRP . . . . . . . . . . . . . 49.0 p90 -152.8 159.26 43.07 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 112.605 -2.089 . . . . 44.93 108.333 -171.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 33' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -70.41 153.34 43.09 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 114.803 -1.089 . . . . 65.27 110.171 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 34' ' ' THR . . . . . 0.685 HG21 ' SG ' ' E' ' 17' ' ' CYS . 5.9 t -157.31 148.17 21.48 Favored 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 107.753 -1.203 . . . . 45.47 107.753 176.063 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.16 148.99 49.13 Favored 'General case' 0 N--CA 1.42 -1.937 0 O-C-N 125.32 1.638 . . . . 34.94 109.052 159.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 36' ' ' VAL . . . . . . . . . . . . . 62.6 t -137.84 116.61 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.104 0 N-CA-C 107.005 -1.48 . . . . 40.34 107.005 173.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 37' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -140.6 167.15 22.85 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 123.653 0.596 . . . . 39.2 110.886 -178.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 38' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -111.81 117.55 33.12 Favored 'General case' 0 C--O 1.258 1.514 0 C-N-CA 126.277 1.831 . . . . 46.59 108.804 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 39' ' ' THR . . . . . . . . . . . . . 28.4 p -76.73 148.54 36.67 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 123.405 1.574 . . . . 58.12 108.473 177.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 40' ' ' THR . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.427 -1.616 0 CA-C-O 116.378 -1.772 . . . . 91.86 109.565 -168.676 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 108.483 -0.932 . . . . 47.49 108.483 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 2' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -69.39 138.97 40.32 Favored 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 121.796 1.664 . . . . 53.42 109.019 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' VAL . . . . . . . . . . . . . 31.5 m -129.95 155.59 80.37 Favored Pre-proline 0 N--CA 1.411 -2.39 0 N-CA-C 107.683 -1.229 . . . . 44.24 107.683 173.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -62.31 151.18 84.0 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.913 2.409 . . . . 46.24 112.763 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.35 128.01 45.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 O-C-N 125.984 2.053 . . . . 52.43 109.524 170.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' THR . . . . . . . . . . . . . 3.2 m -83.09 -51.68 7.31 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.282 -1.326 . . . . 65.87 108.592 -176.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 7' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -147.93 149.23 31.82 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.339 -0.846 . . . . 94.89 109.217 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 8' ' ' LEU . . . . . 0.444 HD11 ' SG ' ' F' ' 17' ' ' CYS . 26.3 tp -130.53 130.16 43.77 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 124.274 1.03 . . . . 53.92 109.844 -178.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 9' ' ' VAL . . . . . . . . . . . . . 10.4 m -142.27 155.2 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 N-CA-C 108.246 -1.02 . . . . 48.54 108.246 179.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 10' ' ' CYS . . . . . . . . . . . . . 57.9 m -128.74 173.65 10.14 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.709 -0.478 . . . . 59.27 109.709 172.955 -54.532 -99.884 104.151 105.843 2.036 106.393 -83.649 -63.361 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 11' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -157.93 119.51 3.6 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 123.345 0.403 . . . . 55.9 111.339 -172.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 12' ' ' GLY . . . . . . . . . . . . . . . -81.18 -10.89 84.22 Favored Glycine 0 C--O 1.249 1.04 0 CA-C-N 115.491 -0.777 . . . . 51.03 113.974 -174.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 13' ' ' ASP . . . . . 0.575 ' OD2' ' N ' ' E' ' 1' ' ' ALA . 21.3 m-20 -82.4 -32.89 28.89 Favored 'General case' 0 C--O 1.251 1.178 0 C-N-CA 119.808 -0.757 . . . . 55.88 109.755 170.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 14' ' ' THR . . . . . . . . . . . . . 29.6 p -100.85 -22.14 14.92 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 118.966 -0.54 . . . . 41.22 112.063 -173.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 15' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 62.49 43.55 7.77 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.541 1.136 . . . . 88.31 108.092 -179.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 16' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -137.44 137.13 38.43 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-N 115.097 -0.956 . . . . 46.84 109.421 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 17' ' ' CYS . . . . . 0.444 ' SG ' HD11 ' F' ' 8' ' ' LEU . 74.6 m -102.06 137.02 40.89 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 126.048 2.092 . . . . 52.9 107.642 163.773 -63.361 -83.649 104.151 106.393 2.036 105.843 -99.884 -54.532 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 18' ' ' THR . . . . . . . . . . . . . 44.7 m -123.04 132.63 54.2 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 125.286 1.434 . . . . 39.1 109.21 -171.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.88 114.68 21.36 Favored 'General case' 0 N--CA 1.435 -1.213 0 O-C-N 123.993 0.808 . . . . 41.81 109.542 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 20' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -83.74 140.31 32.19 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 106.165 -1.791 . . . . 48.85 106.165 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 21' ' ' LEU . . . . . . . . . . . . . 85.0 mt -115.71 144.66 43.64 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-O 122.867 1.318 . . . . 45.88 111.086 -166.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 22' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -89.27 95.62 10.37 Favored 'General case' 0 N--CA 1.416 -2.129 0 CA-C-N 113.136 -1.847 . . . . 64.21 107.865 170.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -169.41 143.84 2.93 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.524 -0.762 . . . . 49.57 108.97 178.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' GLY . . . . . . . . . . . . . . . 55.33 -125.26 35.67 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.286 -0.725 . . . . 52.54 111.286 171.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' ASP . . . . . . . . . . . . . 39.9 p-10 -90.0 5.42 46.63 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.954 1.302 . . . . 67.34 111.613 -174.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' GLY . . . . . . . . . . . . . . . 80.43 10.89 84.8 Favored Glycine 0 N--CA 1.471 1.024 0 CA-C-N 118.343 0.519 . . . . 51.74 113.607 176.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 27' ' ' LYS . . . . . 0.48 ' CE ' ' O ' ' D' ' 39' ' ' THR . 19.0 mtpt -108.49 14.28 24.78 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.729 -1.454 . . . . 83.85 110.729 -175.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 28' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -91.82 127.61 37.35 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 123.243 0.617 . . . . 49.93 109.958 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 29' ' ' VAL . . . . . 0.506 HG22 ' CE1' ' D' ' 37' ' ' PHE . 1.4 m -129.1 143.64 40.61 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.872 0 CA-C-O 121.436 0.636 . . . . 45.0 109.98 176.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 30' ' ' ALA . . . . . . . . . . . . . . . -99.67 142.42 31.18 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 123.36 0.664 . . . . 40.12 110.223 166.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 31' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -149.53 137.81 20.65 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 122.454 1.121 . . . . 36.45 111.846 -176.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 32' ' ' TRP . . . . . . . . . . . . . 47.6 p90 -146.74 161.27 40.97 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 114.349 -1.296 . . . . 38.52 110.32 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 33' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -71.77 145.74 48.53 Favored 'General case' 0 C--O 1.246 0.906 0 CA-C-N 112.966 -1.924 . . . . 62.04 110.472 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 34' ' ' THR . . . . . . . . . . . . . 15.2 t -150.43 146.94 26.98 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 114.152 -1.386 . . . . 55.69 110.726 -179.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.33 145.48 32.07 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.742 -1.577 . . . . 46.65 106.742 162.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 36' ' ' VAL . . . . . . . . . . . . . 33.2 t -127.91 139.35 52.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 107.34 -1.356 . . . . 61.72 107.34 169.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -164.69 164.83 21.28 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.84 1.305 . . . . 81.35 111.506 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 38' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -92.74 147.39 22.9 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 113.448 -1.706 . . . . 82.76 108.823 175.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 39' ' ' THR . . . . . . . . . . . . . 55.3 p . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 121.824 0.821 . . . . 82.35 110.587 -177.184 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' NAG . . . . . 0.464 ' H2 ' ' O ' ' D' ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 101' ' ' MEE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 102' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 103' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 104' ' ' MEE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 102' ' ' FUC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 103' ' ' MEE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' HOH . . . . . 0.419 ' O ' HG21 ' A' ' 39' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 207' ' ' HOH . . . . . 0.464 ' O ' ' H2 ' ' D' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_