data_1ae3_residue 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 1ae3 _Structure_validation_residue.Date_analyzed 2016-10-12 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' ' ' MET . . . . . . . . . . . . . 20.7 ttm . . . . . 0 C--O 1.215 -0.746 0 N-CA-C 115.026 1.491 . . . . 64.66 115.026 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 85.8 mt -100.31 124.33 53.76 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 CA-C-N 123.292 2.769 . . . . 29.47 105.95 174.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -92.59 124.36 36.56 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 124.099 3.136 . . . . 44.46 111.715 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.8 t -120.08 137.13 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.875 0 N-CA-C 105.848 -1.908 . . . . 15.0 105.848 -177.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -128.38 131.33 48.54 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.867 -1.06 . . . . 29.12 113.287 178.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.4 mm -101.58 113.24 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 104.529 -2.397 . . . . 19.18 104.529 171.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . 0.736 ' H ' HE22 ' A' ' 10' ' ' GLN . 9.8 mptt -72.5 150.35 91.38 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 126.305 1.842 . . . . 28.78 113.834 174.647 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -45.71 -38.29 17.05 Favored 'Trans proline' 0 CA--C 1.504 -0.995 0 C-N-CA 124.712 3.608 . . . . 20.51 116.098 169.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.4 p -66.72 -6.97 17.79 Favored 'General case' 0 N--CA 1.513 2.724 0 N-CA-C 117.744 2.498 . . . . 19.82 117.744 173.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLN . . . . . 0.736 HE22 ' H ' ' A' ' 7' ' ' LYS . 21.3 mt-30 -117.7 16.17 14.47 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 120.278 -1.514 . . . . 21.25 114.49 -178.539 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.75 -12.92 61.57 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 117.633 2.457 . . . . 34.41 117.633 -171.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -137.44 178.5 7.05 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 117.13 2.27 . . . . 50.66 117.13 168.908 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -107.8 176.18 5.23 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 117.416 2.376 . . . . 30.94 117.416 -174.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.4 p -122.13 155.03 36.58 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 110.414 -3.085 . . . . 20.99 108.283 170.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 79.9 m -117.85 136.14 53.63 Favored 'General case' 0 CA--C 1.486 -1.485 0 CA-C-O 123.766 1.746 . . . . 18.88 110.769 -174.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -124.6 142.36 51.41 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 112.205 -2.271 . . . . 35.27 109.376 175.586 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.6 p -142.92 175.04 10.14 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 117.44 -1.704 . . . . 32.04 113.159 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 173.84 -161.78 32.31 Favored Glycine 0 C--N 1.305 -1.152 0 CA-C-N 112.17 -2.286 . . . . 31.51 110.695 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -117.71 131.94 68.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 124.535 2.112 . . . . 35.11 115.002 -178.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . 0.839 ' HG ' ' H ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -69.68 157.58 36.99 Favored 'General case' 0 C--N 1.319 -0.736 0 O-C-N 120.519 -1.363 . . . . 43.41 111.328 179.009 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.29 -40.71 62.16 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 115.818 -0.628 . . . . 70.62 110.913 170.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -90.01 50.55 1.89 Allowed 'General case' 0 C--N 1.351 0.659 0 O-C-N 116.503 -3.873 . . . . 75.61 110.731 172.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 45.09 12.99 0.03 OUTLIER Glycine 0 C--N 1.353 1.503 0 N-CA-C 120.32 2.888 . . . . 58.39 120.32 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . 0.839 ' H ' ' HG ' ' A' ' 20' ' ' SER . 22.5 tptt -86.44 123.84 70.65 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 120.2 -1.765 . . . . 54.04 110.589 -174.836 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -59.56 135.4 64.22 Favored 'Trans proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.92 2.413 . . . . 36.51 113.291 174.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -115.94 161.17 19.22 Favored 'General case' 0 CA--C 1.504 -0.789 0 O-C-N 121.229 -0.919 . . . . 30.3 109.326 172.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 m -145.34 129.24 17.37 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.587 -1.642 . . . . 31.01 110.91 168.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -116.78 128.18 55.05 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 126.786 2.035 . . . . 25.12 109.337 -179.737 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -101.21 134.61 44.0 Favored 'General case' 0 C--N 1.291 -1.957 0 O-C-N 119.631 -1.918 . . . . 22.35 108.516 176.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -130.01 144.75 51.5 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 124.162 1.934 . . . . 38.1 111.335 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.8 tt0 -134.78 149.98 50.48 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 113.689 -1.596 . . . . 16.38 109.615 179.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . 0.718 ' H ' ' H2 ' ' A' ' 109' ' ' HOH . 75.7 mt -97.63 145.98 25.76 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-O 123.861 1.791 . . . . 21.29 111.943 175.579 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 18.4 p -147.99 173.99 12.34 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 123.69 1.71 . . . . 15.59 110.885 175.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -112.28 123.98 51.46 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 118.433 -2.667 . . . . 18.08 110.774 173.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 45.6 t -109.01 132.71 56.32 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 O-C-N 120.46 -1.4 . . . . 16.25 109.316 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -83.32 102.29 11.88 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.378 -0.826 . . . . 29.26 108.888 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -94.94 17.08 14.51 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.279 -1.328 . . . . 26.82 113.205 175.614 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.24 2.94 90.71 Favored Glycine 0 N--CA 1.444 -0.816 0 O-C-N 119.788 -1.82 . . . . 39.09 115.203 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 -74.97 -174.87 2.37 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.77 -1.429 . . . . 36.22 109.108 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.95 -37.05 83.26 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 117.22 -3.425 . . . . 62.25 115.954 177.865 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -127.78 152.2 76.68 Favored Pre-proline 0 C--O 1.253 1.284 0 CA-C-N 114.46 -1.246 . . . . 26.75 113.047 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -59.64 152.48 62.3 Favored 'Trans proline' 0 C--N 1.363 1.336 0 C-N-CA 124.139 3.226 . . . . 23.51 111.631 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -100.84 143.86 13.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 CA-C-N 114.659 -1.155 . . . . 27.06 113.483 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.15 120.46 22.25 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 115.64 1.719 . . . . 23.11 115.64 174.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.6 t -121.07 138.39 51.66 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.917 0 CA-C-O 124.575 2.131 . . . . 15.0 110.673 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -86.58 127.1 34.88 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 118.985 -2.322 . . . . 50.31 112.401 169.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -117.09 145.64 22.6 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.516 0 O-C-N 117.719 -3.113 . . . . 24.67 113.713 170.843 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.8 m -108.41 118.3 36.4 Favored 'General case' 0 CA--C 1.499 -1.006 0 O-C-N 119.885 -1.759 . . . . 33.7 108.509 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.82 153.82 42.4 Favored 'General case' 0 C--O 1.245 0.854 0 O-C-N 127.055 2.722 . . . . 31.46 112.541 179.438 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.74 163.73 17.13 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 118.115 -1.434 . . . . 56.06 110.377 175.261 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -52.24 132.56 33.89 Favored 'General case' 0 C--O 1.241 0.633 0 O-C-N 121.806 -0.559 . . . . 63.23 111.324 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.74 -1.54 67.13 Favored Glycine 0 CA--C 1.545 1.955 0 N-CA-C 118.402 2.121 . . . . 48.56 118.402 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -90.6 126.07 57.38 Favored Pre-proline 0 C--O 1.242 0.677 0 O-C-N 121.263 -1.14 . . . . 47.45 108.221 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -68.33 166.42 25.45 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.734 2.956 . . . . 30.36 112.738 172.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.36 141.86 49.98 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 121.661 -0.65 . . . . 23.38 109.997 171.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . 0.876 ' HH ' ' H1 ' ' A' ' 91' ' ' HOH . 97.4 m-85 -60.67 137.3 58.2 Favored 'General case' 0 CA--C 1.554 1.116 0 O-C-N 119.477 -2.014 . . . . 25.05 111.568 174.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . 0.637 ' H ' ' H1 ' ' A' ' 92' ' ' HOH . . . -65.93 161.1 57.69 Favored Pre-proline 0 CA--C 1.548 0.904 1 O-C-N 116.071 -4.143 . . . . 18.34 114.409 172.962 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -52.24 142.96 44.51 Favored 'Trans proline' 0 C--N 1.324 -0.724 0 O-C-N 116.399 -2.474 . . . . 24.9 113.397 170.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 142.15 -171.19 24.68 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-O 123.184 1.435 . . . . 20.33 113.624 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . 0.99 ' H ' ' H1 ' ' A' ' 95' ' ' HOH . 53.8 mt -103.74 131.07 51.25 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 128.127 2.571 . . . . 24.63 114.828 -176.193 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -131.78 162.5 30.36 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 113.082 -1.872 . . . . 25.38 108.165 -174.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -122.28 175.85 6.18 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 118.425 -1.31 . . . . 25.16 113.005 160.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.5 t -88.61 131.26 36.49 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.552 1 O-C-N 116.031 -4.168 . . . . 25.7 118.311 -179.745 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -78.63 141.67 37.83 Favored 'General case' 0 CA--C 1.497 -1.072 1 O-C-N 116.057 -4.152 . . . . 20.64 111.569 179.345 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.63 -29.76 27.93 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.878 1.436 . . . . 24.66 114.878 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 88.3 p -65.67 -9.95 32.02 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 115.01 1.485 . . . . 28.41 115.01 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . 0.772 ' HG ' ' H ' ' A' ' 82' ' ' CYS . 4.2 m -64.97 -18.26 65.11 Favored 'General case' 0 CA--C 1.509 -0.628 0 O-C-N 119.807 -1.808 . . . . 15.0 115.145 171.865 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -104.27 152.17 22.53 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 116.902 2.186 . . . . 23.74 116.902 -176.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 pttm -155.35 162.19 40.88 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 119.385 -2.072 . . . . 52.13 110.718 174.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 86.0 t -81.1 124.97 39.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.628 -1.249 . . . . 16.51 107.628 173.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -79.22 179.37 53.01 Favored Glycine 0 CA--C 1.541 1.665 0 CA-C-O 126.232 3.129 . . . . 19.37 116.289 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -64.63 -16.55 62.93 Favored 'General case' 0 CA--C 1.499 -1.008 0 CA-C-O 116.051 -1.928 . . . . 49.54 115.786 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -106.51 10.75 31.21 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 119.911 1.232 . . . . 22.24 111.161 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.95 -1.24 80.34 Favored Glycine 0 CA--C 1.489 -1.551 0 O-C-N 120.898 -1.126 . . . . 15.0 114.292 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 80.2 p -99.83 158.22 15.95 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 119.46 -2.2 . . . . 31.62 112.947 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.6 tp -73.08 143.06 47.56 Favored 'General case' 0 CA--C 1.495 -1.158 0 O-C-N 120.742 -1.224 . . . . 17.45 111.404 -178.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 7.0 ptp -145.85 158.79 43.84 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 116.177 1.917 . . . . 39.28 116.177 175.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . 0.502 ' H ' ' H1 ' ' A' ' 103' ' ' HOH . 78.1 mt -78.92 127.07 39.17 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 116.957 -3.589 . . . . 18.49 109.303 173.745 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -79.32 -71.12 0.46 Allowed 'General case' 0 C--N 1.308 -1.203 1 O-C-N 115.376 -4.577 . . . . 28.76 112.158 168.735 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 mmm-85 -138.35 126.72 23.13 Favored 'General case' 0 C--O 1.247 0.965 0 N-CA-C 102.367 -3.198 . . . . 63.37 102.367 176.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.4 tp -66.6 121.44 15.37 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.307 0.855 . . . . 27.51 113.307 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' CYS . . . . . 0.772 ' H ' ' HG ' ' A' ' 67' ' ' SER . 49.3 t -111.63 119.79 39.87 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-O 123.387 1.565 . . . . 35.48 111.917 178.754 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 55.9 mt -95.31 140.1 30.67 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 117.309 -3.369 . . . . 22.69 115.192 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.6 m -119.3 145.24 38.08 Favored Pre-proline 0 C--O 1.239 0.539 0 O-C-N 119.116 -2.24 . . . . 30.57 108.957 172.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -58.59 131.83 44.72 Favored 'Trans proline' 0 N--CA 1.438 -1.743 0 CA-C-N 125.133 2.869 . . . . 26.28 110.059 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.862 2 O-C-N 132.208 5.943 . . . . 43.5 112.907 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . 0.876 ' H1 ' ' HH ' ' A' ' 56' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . 0.637 ' H1 ' ' H ' ' A' ' 57' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . 0.99 ' H1 ' ' H ' ' A' ' 60' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . 0.502 ' H1 ' ' H ' ' A' ' 78' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . 0.718 ' H2 ' ' H ' ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.7 ttm . . . . . 0 C--O 1.215 -0.746 0 N-CA-C 115.026 1.491 . . . . 64.66 115.026 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 85.8 mt -100.31 124.33 53.76 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 CA-C-N 123.292 2.769 . . . . 29.47 105.95 174.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -92.59 124.36 36.56 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 124.099 3.136 . . . . 44.46 111.715 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.8 t -120.08 137.13 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.875 0 N-CA-C 105.848 -1.908 . . . . 14.65 105.848 -177.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . 0.446 ' HG3' HD23 ' A' ' 60' ' ' LEU . 35.9 tt0 -128.38 131.33 48.54 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.867 -1.06 . . . . 29.12 113.287 178.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.4 mm -101.58 113.24 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 104.529 -2.397 . . . . 19.18 104.529 171.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -72.5 150.35 91.38 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 126.305 1.842 . . . . 28.78 113.834 174.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -45.71 -38.29 17.05 Favored 'Trans proline' 0 CA--C 1.504 -0.995 0 C-N-CA 124.712 3.608 . . . . 20.51 116.098 169.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.4 p -66.72 -6.97 17.79 Favored 'General case' 0 N--CA 1.513 2.724 0 N-CA-C 117.744 2.498 . . . . 19.82 117.744 173.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -117.7 16.17 14.47 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 120.278 -1.514 . . . . 21.25 114.49 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.75 -12.92 61.57 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 117.633 2.457 . . . . 34.41 117.633 -171.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . 0.489 ' HA ' ' CB ' ' A' ' 55' ' ' ALA . 0.6 OUTLIER -137.44 178.5 7.05 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 117.13 2.27 . . . . 50.66 117.13 168.908 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -107.8 176.18 5.23 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 117.416 2.376 . . . . 30.94 117.416 -174.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.4 p -122.13 155.03 36.58 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 110.414 -3.085 . . . . 20.99 108.283 170.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 79.9 m -117.85 136.14 53.63 Favored 'General case' 0 CA--C 1.486 -1.485 0 CA-C-O 123.766 1.746 . . . . 18.88 110.769 -174.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -124.6 142.36 51.41 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 112.205 -2.271 . . . . 35.27 109.376 175.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.6 p -142.92 175.04 10.14 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 117.44 -1.704 . . . . 32.04 113.159 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 173.84 -161.78 32.31 Favored Glycine 0 C--N 1.305 -1.152 0 CA-C-N 112.17 -2.286 . . . . 31.51 110.695 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -117.71 131.94 68.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 124.535 2.112 . . . . 35.11 115.002 -178.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -69.68 157.58 36.99 Favored 'General case' 0 C--N 1.319 -0.736 0 O-C-N 120.519 -1.363 . . . . 43.41 111.328 179.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . 0.582 ' NH1' ' HB2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -52.29 -40.71 62.16 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 115.818 -0.628 . . . . 70.62 110.913 170.479 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLN . . . . . 0.582 ' HB2' ' NH1' ' A' ' 21' ' ' ARG . 23.5 mt-30 -90.01 50.55 1.89 Allowed 'General case' 0 C--N 1.351 0.659 0 O-C-N 116.503 -3.873 . . . . 75.61 110.731 172.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 45.09 12.99 0.03 OUTLIER Glycine 0 C--N 1.353 1.503 0 N-CA-C 120.32 2.888 . . . . 58.39 120.32 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.5 tptt -86.44 123.84 70.65 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 120.2 -1.765 . . . . 54.04 110.589 -174.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -59.56 135.4 64.22 Favored 'Trans proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.92 2.413 . . . . 36.51 113.291 174.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -115.94 161.17 19.22 Favored 'General case' 0 CA--C 1.504 -0.789 0 O-C-N 121.229 -0.919 . . . . 30.3 109.326 172.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 m -145.34 129.24 17.37 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.587 -1.642 . . . . 31.01 110.91 168.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -116.78 128.18 55.05 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 126.786 2.035 . . . . 25.12 109.337 -179.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -101.21 134.61 44.0 Favored 'General case' 0 C--N 1.291 -1.957 0 O-C-N 119.631 -1.918 . . . . 22.35 108.516 176.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -130.01 144.75 51.5 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 124.162 1.934 . . . . 38.1 111.335 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.8 tt0 -134.78 149.98 50.48 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 113.689 -1.596 . . . . 16.38 109.615 179.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . 0.443 HD21 ' HE2' ' A' ' 46' ' ' LYS . 75.7 mt -97.63 145.98 25.76 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-O 123.861 1.791 . . . . 21.29 111.943 175.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 18.4 p -147.99 173.99 12.34 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 123.69 1.71 . . . . 15.59 110.885 175.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -112.28 123.98 51.46 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 118.433 -2.667 . . . . 18.08 110.774 173.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 45.6 t -109.01 132.71 56.32 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 O-C-N 120.46 -1.4 . . . . 16.25 109.316 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -83.32 102.29 11.88 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.378 -0.826 . . . . 29.26 108.888 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . 0.461 HD22 HG11 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -94.94 17.08 14.51 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.279 -1.328 . . . . 26.82 113.205 175.614 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.24 2.94 90.71 Favored Glycine 0 N--CA 1.444 -0.816 0 O-C-N 119.788 -1.82 . . . . 39.09 115.203 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 -74.97 -174.87 2.37 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.77 -1.429 . . . . 36.22 109.108 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.95 -37.05 83.26 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 117.22 -3.425 . . . . 62.25 115.954 177.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -127.78 152.2 76.68 Favored Pre-proline 0 C--O 1.253 1.284 0 CA-C-N 114.46 -1.246 . . . . 26.75 113.047 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -59.64 152.48 62.3 Favored 'Trans proline' 0 C--N 1.363 1.336 0 C-N-CA 124.139 3.226 . . . . 23.51 111.631 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . 0.461 HG11 HD22 ' A' ' 37' ' ' LEU . 1.2 p -100.84 143.86 13.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 CA-C-N 114.659 -1.155 . . . . 27.06 113.483 -178.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.15 120.46 22.25 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 115.64 1.719 . . . . 23.11 115.64 174.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.6 t -121.07 138.39 51.66 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.917 0 CA-C-O 124.575 2.131 . . . . 13.82 110.673 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . 0.443 ' HE2' HD21 ' A' ' 32' ' ' LEU . 5.9 ttmm -86.58 127.1 34.88 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 118.985 -2.322 . . . . 50.31 112.401 169.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -117.09 145.64 22.6 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.516 0 O-C-N 117.719 -3.113 . . . . 24.67 113.713 170.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.8 m -108.41 118.3 36.4 Favored 'General case' 0 CA--C 1.499 -1.006 0 O-C-N 119.885 -1.759 . . . . 33.7 108.509 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.82 153.82 42.4 Favored 'General case' 0 C--O 1.245 0.854 0 O-C-N 127.055 2.722 . . . . 31.46 112.541 179.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.74 163.73 17.13 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 118.115 -1.434 . . . . 56.06 110.377 175.261 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -52.24 132.56 33.89 Favored 'General case' 0 C--O 1.241 0.633 0 O-C-N 121.806 -0.559 . . . . 63.23 111.324 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.74 -1.54 67.13 Favored Glycine 0 CA--C 1.545 1.955 0 N-CA-C 118.402 2.121 . . . . 48.56 118.402 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -90.6 126.07 57.38 Favored Pre-proline 0 C--O 1.242 0.677 0 O-C-N 121.263 -1.14 . . . . 47.45 108.221 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -68.33 166.42 25.45 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.734 2.956 . . . . 30.36 112.738 172.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 12' ' ' GLN . . . -58.36 141.86 49.98 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 121.661 -0.65 . . . . 23.38 109.997 171.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -60.67 137.3 58.2 Favored 'General case' 0 CA--C 1.554 1.116 0 O-C-N 119.477 -2.014 . . . . 25.05 111.568 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.93 161.1 57.69 Favored Pre-proline 0 CA--C 1.548 0.904 1 O-C-N 116.071 -4.143 . . . . 18.34 114.409 172.962 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -52.24 142.96 44.51 Favored 'Trans proline' 0 C--N 1.324 -0.724 0 O-C-N 116.399 -2.474 . . . . 24.9 113.397 170.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 142.15 -171.19 24.68 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-O 123.184 1.435 . . . . 20.33 113.624 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . 0.446 HD23 ' HG3' ' A' ' 5' ' ' GLU . 53.8 mt -103.74 131.07 51.25 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 128.127 2.571 . . . . 24.63 114.828 -176.193 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -131.78 162.5 30.36 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 113.082 -1.872 . . . . 25.38 108.165 -174.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -122.28 175.85 6.18 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 118.425 -1.31 . . . . 25.16 113.005 160.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.5 t -88.61 131.26 36.49 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.552 1 O-C-N 116.031 -4.168 . . . . 25.7 118.311 -179.745 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -78.63 141.67 37.83 Favored 'General case' 0 CA--C 1.497 -1.072 1 O-C-N 116.057 -4.152 . . . . 20.64 111.569 179.345 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.63 -29.76 27.93 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.878 1.436 . . . . 24.66 114.878 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 88.3 p -65.67 -9.95 32.02 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 115.01 1.485 . . . . 28.41 115.01 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.2 m -64.97 -18.26 65.11 Favored 'General case' 0 CA--C 1.509 -0.628 0 O-C-N 119.807 -1.808 . . . . 13.53 115.145 171.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -104.27 152.17 22.53 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 116.902 2.186 . . . . 23.74 116.902 -176.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . 0.425 ' HE2' ' SD ' ' A' ' 77' ' ' MET . 14.5 pttm -155.35 162.19 40.88 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 119.385 -2.072 . . . . 52.13 110.718 174.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 86.0 t -81.1 124.97 39.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.628 -1.249 . . . . 16.51 107.628 173.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -79.22 179.37 53.01 Favored Glycine 0 CA--C 1.541 1.665 0 CA-C-O 126.232 3.129 . . . . 19.37 116.289 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -64.63 -16.55 62.93 Favored 'General case' 0 CA--C 1.499 -1.008 0 CA-C-O 116.051 -1.928 . . . . 49.54 115.786 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -106.51 10.75 31.21 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 119.911 1.232 . . . . 22.24 111.161 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.95 -1.24 80.34 Favored Glycine 0 CA--C 1.489 -1.551 0 O-C-N 120.898 -1.126 . . . . 14.49 114.292 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 80.2 p -99.83 158.22 15.95 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 119.46 -2.2 . . . . 31.62 112.947 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.6 tp -73.08 143.06 47.56 Favored 'General case' 0 CA--C 1.495 -1.158 0 O-C-N 120.742 -1.224 . . . . 17.45 111.404 -178.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' MET . . . . . 0.425 ' SD ' ' HE2' ' A' ' 69' ' ' LYS . 7.0 ptp -145.85 158.79 43.84 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 116.177 1.917 . . . . 39.28 116.177 175.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 78.1 mt -78.92 127.07 39.17 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 116.957 -3.589 . . . . 18.49 109.303 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -79.32 -71.12 0.46 Allowed 'General case' 0 C--N 1.308 -1.203 1 O-C-N 115.376 -4.577 . . . . 28.76 112.158 168.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 mmm-85 -138.35 126.72 23.13 Favored 'General case' 0 C--O 1.247 0.965 0 N-CA-C 102.367 -3.198 . . . . 63.37 102.367 176.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.4 tp -66.6 121.44 15.37 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.307 0.855 . . . . 27.51 113.307 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 49.3 t -111.63 119.79 39.87 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-O 123.387 1.565 . . . . 35.48 111.917 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 55.9 mt -95.31 140.1 30.67 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 117.309 -3.369 . . . . 22.69 115.192 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.6 m -119.3 145.24 38.08 Favored Pre-proline 0 C--O 1.239 0.539 0 O-C-N 119.116 -2.24 . . . . 30.57 108.957 172.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -58.59 131.83 44.72 Favored 'Trans proline' 0 N--CA 1.438 -1.743 0 CA-C-N 125.133 2.869 . . . . 26.28 110.059 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.862 2 O-C-N 132.208 5.943 . . . . 43.5 112.907 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.7 ttm . . . . . 0 C--O 1.215 -0.746 0 N-CA-C 115.026 1.491 . . . . 64.659999999999997 115.026 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 85.8 mt -100.31 124.33 53.76 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.796 0 CA-C-N 123.292 2.769 . . . . 29.469999999999999 105.95 174.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -92.59 124.36 36.56 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 124.099 3.136 . . . . 44.460000000000001 111.715 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.8 t -120.08 137.13 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.875 0 N-CA-C 105.848 -1.908 . . . . 14.65 105.848 -177.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.446 ' HG3' HD23 ' A' ' 60' ' ' LEU . 35.9 tt0 -128.38 131.33 48.54 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.867 -1.06 . . . . 29.120000000000001 113.287 178.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.4 mm -101.58 113.24 37.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 N-CA-C 104.529 -2.397 . . . . 19.18 104.529 171.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.571 ' H ' HE21 ' A' ' 10' ' ' GLN . 9.8 mptt -72.5 150.35 91.38 Favored Pre-proline 0 N--CA 1.477 0.899 0 C-N-CA 126.305 1.842 . . . . 28.780000000000001 113.834 174.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -45.71 -38.29 17.05 Favored 'Trans proline' 0 CA--C 1.504 -0.995 0 C-N-CA 124.712 3.608 . . . . 20.510000000000002 116.098 169.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.4 p -66.72 -6.97 17.79 Favored 'General case' 0 N--CA 1.513 2.724 0 N-CA-C 117.744 2.498 . . . . 19.82 117.744 173.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.571 HE21 ' H ' ' A' ' 7' ' ' LYS . 21.3 mt-30 -117.7 16.17 14.47 Favored 'General case' 0 CA--C 1.542 0.636 0 O-C-N 120.278 -1.514 . . . . 21.25 114.49 -178.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.75 -12.92 61.57 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 117.633 2.457 . . . . 34.409999999999997 117.633 -171.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.489 ' HA ' ' CB ' ' A' ' 55' ' ' ALA . 0.6 OUTLIER -137.44 178.5 7.05 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 117.13 2.27 . . . . 50.659999999999997 117.13 168.908 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -107.8 176.18 5.23 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 117.416 2.376 . . . . 30.940000000000001 117.416 -174.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.4 p -122.13 155.03 36.58 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 110.414 -3.085 . . . . 20.989999999999998 108.283 170.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 79.9 m -117.85 136.14 53.63 Favored 'General case' 0 CA--C 1.486 -1.485 0 CA-C-O 123.766 1.746 . . . . 18.879999999999999 110.769 -174.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -124.6 142.36 51.41 Favored 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 112.205 -2.271 . . . . 35.270000000000003 109.376 175.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.6 p -142.92 175.04 10.14 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 117.44 -1.704 . . . . 32.039999999999999 113.159 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 173.84 -161.78 32.31 Favored Glycine 0 C--N 1.305 -1.152 0 CA-C-N 112.17 -2.286 . . . . 31.510000000000002 110.695 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -117.71 131.94 68.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 124.535 2.112 . . . . 35.109999999999999 115.002 -178.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -69.68 157.58 36.99 Favored 'General case' 0 C--N 1.319 -0.736 0 O-C-N 120.519 -1.363 . . . . 43.409999999999997 111.328 179.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.582 ' NH1' ' HB2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -52.29 -40.71 62.16 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 115.818 -0.628 . . . . 70.620000000000005 110.913 170.479 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.582 ' HB2' ' NH1' ' A' ' 21' ' ' ARG . 23.5 mt-30 -90.01 50.55 1.89 Allowed 'General case' 0 C--N 1.351 0.659 0 O-C-N 116.503 -3.873 . . . . 75.609999999999999 110.731 172.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 45.09 12.99 0.03 OUTLIER Glycine 0 C--N 1.353 1.503 0 N-CA-C 120.32 2.888 . . . . 58.390000000000001 120.32 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.5 tptt -86.44 123.84 70.65 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 120.2 -1.765 . . . . 54.039999999999999 110.589 -174.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -59.56 135.4 64.22 Favored 'Trans proline' 0 N--CA 1.448 -1.187 0 C-N-CA 122.92 2.413 . . . . 36.509999999999998 113.291 174.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -115.94 161.17 19.22 Favored 'General case' 0 CA--C 1.504 -0.789 0 O-C-N 121.229 -0.919 . . . . 30.300000000000001 109.326 172.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 m -145.34 129.24 17.37 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.587 -1.642 . . . . 31.010000000000002 110.91 168.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -116.78 128.18 55.05 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 126.786 2.035 . . . . 25.120000000000001 109.337 -179.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -101.21 134.61 44.0 Favored 'General case' 0 C--N 1.291 -1.957 0 O-C-N 119.631 -1.918 . . . . 22.350000000000001 108.516 176.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -130.01 144.75 51.5 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 124.162 1.934 . . . . 38.100000000000001 111.335 -176.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.8 tt0 -134.78 149.98 50.48 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 113.689 -1.596 . . . . 16.379999999999999 109.615 179.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.443 HD21 ' HE2' ' A' ' 46' ' ' LYS . 75.7 mt -97.63 145.98 25.76 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-O 123.861 1.791 . . . . 21.289999999999999 111.943 175.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 18.4 p -147.99 173.99 12.34 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 123.69 1.71 . . . . 15.59 110.885 175.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -112.28 123.98 51.46 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 118.433 -2.667 . . . . 18.079999999999998 110.774 173.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 45.6 t -109.01 132.71 56.32 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.498 0 O-C-N 120.46 -1.4 . . . . 16.25 109.316 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -83.32 102.29 11.88 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.378 -0.826 . . . . 29.260000000000002 108.888 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.461 HD22 HG11 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -94.94 17.08 14.51 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.279 -1.328 . . . . 26.82 113.205 175.614 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.24 2.94 90.71 Favored Glycine 0 N--CA 1.444 -0.816 0 O-C-N 119.788 -1.82 . . . . 39.090000000000003 115.203 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 -74.97 -174.87 2.37 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.77 -1.429 . . . . 36.219999999999999 109.108 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.95 -37.05 83.26 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 117.22 -3.425 . . . . 62.25 115.954 177.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -127.78 152.2 76.68 Favored Pre-proline 0 C--O 1.253 1.284 0 CA-C-N 114.46 -1.246 . . . . 26.75 113.047 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -59.64 152.48 62.3 Favored 'Trans proline' 0 C--N 1.363 1.336 0 C-N-CA 124.139 3.226 . . . . 23.510000000000002 111.631 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.461 HG11 HD22 ' A' ' 37' ' ' LEU . 1.2 p -100.84 143.86 13.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 CA-C-N 114.659 -1.155 . . . . 27.059999999999999 113.483 -178.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.15 120.46 22.25 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 115.64 1.719 . . . . 23.109999999999999 115.64 174.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 40.6 t -121.07 138.39 51.66 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.917 0 CA-C-O 124.575 2.131 . . . . 13.82 110.673 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.443 ' HE2' HD21 ' A' ' 32' ' ' LEU . 5.9 ttmm -86.58 127.1 34.88 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 118.985 -2.322 . . . . 50.310000000000002 112.401 169.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -117.09 145.64 22.6 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.516 0 O-C-N 117.719 -3.113 . . . . 24.670000000000002 113.713 170.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.8 m -108.41 118.3 36.4 Favored 'General case' 0 CA--C 1.499 -1.006 0 O-C-N 119.885 -1.759 . . . . 33.700000000000003 108.509 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.82 153.82 42.4 Favored 'General case' 0 C--O 1.245 0.854 0 O-C-N 127.055 2.722 . . . . 31.460000000000001 112.541 179.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.74 163.73 17.13 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 118.115 -1.434 . . . . 56.060000000000002 110.377 175.261 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -52.24 132.56 33.89 Favored 'General case' 0 C--O 1.241 0.633 0 O-C-N 121.806 -0.559 . . . . 63.229999999999997 111.324 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.74 -1.54 67.13 Favored Glycine 0 CA--C 1.545 1.955 0 N-CA-C 118.402 2.121 . . . . 48.560000000000002 118.402 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -90.6 126.07 57.38 Favored Pre-proline 0 C--O 1.242 0.677 0 O-C-N 121.263 -1.14 . . . . 47.450000000000003 108.221 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -68.33 166.42 25.45 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.734 2.956 . . . . 30.359999999999999 112.738 172.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.489 ' CB ' ' HA ' ' A' ' 12' ' ' GLN . . . -58.36 141.86 49.98 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 121.661 -0.65 . . . . 23.379999999999999 109.997 171.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -60.67 137.3 58.2 Favored 'General case' 0 CA--C 1.554 1.116 0 O-C-N 119.477 -2.014 . . . . 25.050000000000001 111.568 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.93 161.1 57.69 Favored Pre-proline 0 CA--C 1.548 0.904 1 O-C-N 116.071 -4.143 . . . . 18.34 114.409 172.962 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -52.24 142.96 44.51 Favored 'Trans proline' 0 C--N 1.324 -0.724 0 O-C-N 116.399 -2.474 . . . . 24.899999999999999 113.397 170.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 142.15 -171.19 24.68 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-O 123.184 1.435 . . . . 20.329999999999998 113.624 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.446 HD23 ' HG3' ' A' ' 5' ' ' GLU . 53.8 mt -103.74 131.07 51.25 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 128.127 2.571 . . . . 24.629999999999999 114.828 -176.193 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 95.4 m-85 -131.78 162.5 30.36 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 113.082 -1.872 . . . . 25.379999999999999 108.165 -174.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -122.28 175.85 6.18 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 118.425 -1.31 . . . . 25.16 113.005 160.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.5 t -88.61 131.26 36.49 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.552 1 O-C-N 116.031 -4.168 . . . . 25.699999999999999 118.311 -179.745 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -78.63 141.67 37.83 Favored 'General case' 0 CA--C 1.497 -1.072 1 O-C-N 116.057 -4.152 . . . . 20.640000000000001 111.569 179.345 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.0 mt -52.63 -29.76 27.93 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.878 1.436 . . . . 24.66 114.878 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 88.3 p -65.67 -9.95 32.02 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 115.01 1.485 . . . . 28.41 115.01 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.2 m -64.97 -18.26 65.11 Favored 'General case' 0 CA--C 1.509 -0.628 0 O-C-N 119.807 -1.808 . . . . 13.529999999999999 115.145 171.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -104.27 152.17 22.53 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 116.902 2.186 . . . . 23.739999999999998 116.902 -176.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.425 ' HE2' ' SD ' ' A' ' 77' ' ' MET . 14.5 pttm -155.35 162.19 40.88 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 119.385 -2.072 . . . . 52.130000000000003 110.718 174.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 86.0 t -81.1 124.97 39.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.628 -1.249 . . . . 16.510000000000002 107.628 173.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -79.22 179.37 53.01 Favored Glycine 0 CA--C 1.541 1.665 0 CA-C-O 126.232 3.129 . . . . 19.370000000000001 116.289 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -64.63 -16.55 62.93 Favored 'General case' 0 CA--C 1.499 -1.008 0 CA-C-O 116.051 -1.928 . . . . 49.539999999999999 115.786 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -106.51 10.75 31.21 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 119.911 1.232 . . . . 22.239999999999998 111.161 176.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.95 -1.24 80.34 Favored Glycine 0 CA--C 1.489 -1.551 0 O-C-N 120.898 -1.126 . . . . 14.49 114.292 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 80.2 p -99.83 158.22 15.95 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 119.46 -2.2 . . . . 31.620000000000001 112.947 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.6 tp -73.08 143.06 47.56 Favored 'General case' 0 CA--C 1.495 -1.158 0 O-C-N 120.742 -1.224 . . . . 17.449999999999999 111.404 -178.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' MET . . . . . 0.425 ' SD ' ' HE2' ' A' ' 69' ' ' LYS . 7.0 ptp -145.85 158.79 43.84 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 116.177 1.917 . . . . 39.280000000000001 116.177 175.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 78.1 mt -78.92 127.07 39.17 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 O-C-N 116.957 -3.589 . . . . 18.489999999999998 109.303 173.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -79.32 -71.12 0.46 Allowed 'General case' 0 C--N 1.308 -1.203 1 O-C-N 115.376 -4.577 . . . . 28.760000000000002 112.158 168.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 mmm-85 -138.35 126.72 23.13 Favored 'General case' 0 C--O 1.247 0.965 0 N-CA-C 102.367 -3.198 . . . . 63.369999999999997 102.367 176.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.4 tp -66.6 121.44 15.37 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.307 0.855 . . . . 27.510000000000002 113.307 176.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 49.3 t -111.63 119.79 39.87 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-O 123.387 1.565 . . . . 35.479999999999997 111.917 178.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 55.9 mt -95.31 140.1 30.67 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 117.309 -3.369 . . . . 22.690000000000001 115.192 -172.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.6 m -119.3 145.24 38.08 Favored Pre-proline 0 C--O 1.239 0.539 0 O-C-N 119.116 -2.24 . . . . 30.57 108.957 172.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -58.59 131.83 44.72 Favored 'Trans proline' 0 N--CA 1.438 -1.743 0 CA-C-N 125.133 2.869 . . . . 26.280000000000001 110.059 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.862 2 O-C-N 132.208 5.943 . . . . 43.5 112.907 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_