data_1bzo_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 1bzo _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 ' 2' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.501 -0.916 0 N-CA-C 113.324 0.861 . . . . 100.0 113.324 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -142.35 135.55 28.76 Favored 'General case' 0 C--O 1.201 -1.481 0 N-CA-C 106.744 -1.576 . . . . 69.23 106.744 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 15.3 mt -120.18 152.26 37.93 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.268 -1.52 . . . . 43.14 110.894 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 p -103.8 128.88 51.19 Favored 'General case' 0 N--CA 1.425 -1.686 0 O-C-N 127.103 2.752 . . . . 30.37 105.924 174.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.1 t -115.46 121.98 68.36 Favored 'Isoleucine or valine' 0 C--N 1.363 1.189 0 C-N-CA 127.053 2.141 . . . . 29.32 111.572 172.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.6 pttt -86.6 132.25 33.95 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 106.826 -1.546 . . . . 58.01 106.826 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 34.5 mmm -107.86 140.14 41.41 Favored 'General case' 0 N--CA 1.437 -1.098 0 O-C-N 124.708 1.255 . . . . 25.02 111.221 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.0 m -123.93 141.43 52.04 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 114.848 -1.069 . . . . 40.12 112.958 179.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' A ASP . . . . . . . . . . . . . 9.8 t70 -70.8 126.4 29.5 Favored 'General case' 0 CA--C 1.494 -1.189 0 CA-C-O 113.97 -2.919 . . . . 31.55 107.173 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' B LEU . . . . . . . . . . . . . 84.4 mt -75.41 -26.68 58.6 Favored 'General case' 0 C--N 1.355 0.808 0 O-C-N 126.508 2.38 . . . . 26.33 114.802 -175.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 mp0 -81.47 -48.2 12.18 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 112.86 -1.973 . . . . 60.38 112.806 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 49.1 p -88.45 -24.89 22.89 Favored 'General case' 0 C--O 1.2 -1.502 0 N-CA-C 116.131 1.9 . . . . 33.57 116.131 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.55 2.57 90.56 Favored Glycine 0 CA--C 1.564 3.121 0 CA-C-O 123.469 1.594 . . . . 31.61 113.594 -176.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -99.12 153.52 37.75 Favored Pre-proline 0 C--O 1.205 -1.28 0 O-C-N 119.034 -2.451 . . . . 83.16 111.553 -176.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -61.14 144.75 99.23 Favored 'Trans proline' 0 N--CA 1.43 -2.235 0 C-N-CA 121.415 1.41 . . . . 24.04 112.81 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.256 27.2 m -116.85 0.64 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 N-CA-C 116.869 2.174 . . . . 32.38 116.869 176.858 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.85 -150.9 16.84 Favored Glycine 0 C--O 1.211 -1.328 0 N-CA-C 109.065 -1.614 . . . . 21.49 109.065 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.9 p -146.74 168.84 20.37 Favored 'General case' 0 C--O 1.264 1.821 0 O-C-N 119.637 -2.096 . . . . 48.27 111.109 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 mt -130.25 130.21 65.5 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.875 0 N-CA-C 104.72 -2.326 . . . . 16.13 104.72 176.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.76 136.0 33.62 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 125.964 2.04 . . . . 100.0 110.182 178.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.9 mp -112.71 131.22 55.76 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 117.696 -1.601 . . . . 27.73 109.922 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.7 p -136.97 146.85 45.86 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 113.971 1.1 . . . . 42.45 113.971 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -99.09 137.76 37.15 Favored 'General case' 0 N--CA 1.419 -2.021 0 C-N-CA 116.009 -2.276 . . . . 40.63 111.342 -177.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . 0.521 ' OD1' ' N ' ' A' ' 25' ' ' TYR 0.428 0.9 OUTLIER -139.27 174.51 10.43 Favored 'General case' 0 N--CA 1.42 -1.938 0 C-N-CA 116.806 -1.958 . . . . 55.69 111.28 175.294 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . 0.426 ' CD ' ' CZ ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -57.84 -23.93 55.08 Favored 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 113.023 -1.899 . . . . 93.51 113.54 -179.849 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . 0.521 ' N ' ' OD1' ' A' ' 23' ' ' ASN . 81.7 m-85 -104.64 1.14 29.23 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 118.243 -1.383 . . . . 27.15 111.703 -177.883 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.84 -157.79 25.43 Favored Glycine 0 N--CA 1.47 0.925 0 O-C-N 119.461 -2.025 . . . . 20.69 110.951 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.5 t -98.68 129.63 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 112.684 0.624 . . . . 19.75 112.684 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.7 t -100.07 131.62 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 CA-C-O 122.487 1.136 . . . . 25.15 111.014 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -111.35 116.05 30.31 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 106.214 -1.772 . . . . 22.8 106.214 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.9 mp -112.85 105.47 55.79 Favored Pre-proline 0 CA--C 1.555 1.163 0 CA-C-O 122.817 1.294 . . . . 24.46 110.729 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -82.53 149.65 14.69 Favored 'Trans proline' 0 C--O 1.207 -1.061 0 C-N-CA 122.31 2.007 . . . . 21.8 114.09 -176.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -138.82 74.03 1.46 Allowed 'General case' 0 C--O 1.189 -2.121 0 N-CA-C 103.788 -2.671 . . . . 100.0 103.788 172.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.5 mt -123.09 167.23 13.93 Favored 'General case' 0 N--CA 1.439 -1.021 0 O-C-N 124.592 1.182 . . . . 25.98 110.652 -174.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -162.78 166.35 24.34 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 103.647 -2.723 . . . . 30.05 103.647 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . 0.373 80.0 m-20 75.49 29.57 0.88 Allowed 'General case' 0 C--O 1.254 1.308 0 N-CA-C 114.413 1.264 . . . . 39.5 114.413 178.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 13.3 mt -118.27 174.55 6.16 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 114.798 -1.092 . . . . 33.14 109.165 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . 0.509 ' O ' ' NE2' ' A' ' 41' ' ' HIS . 2.8 p -93.88 125.73 52.01 Favored Pre-proline 0 C--O 1.257 1.48 0 CA-C-O 121.992 0.901 . . . . 34.34 113.428 -178.676 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -50.68 141.09 35.66 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 CA-C-O 124.795 1.915 . . . . 29.25 113.041 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . 0.61 ' O ' ' N ' ' A' ' 87' ' ' VAL . . . 123.96 -162.56 17.96 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 111.946 -2.388 . . . . 29.35 111.035 -177.241 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 13.1 mmt -102.93 136.4 42.81 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 126.586 1.954 . . . . 31.34 107.652 -176.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HIS . . . . . 0.509 ' NE2' ' O ' ' A' ' 37' ' ' THR . 81.2 m-70 -128.36 140.88 51.62 Favored 'General case' 0 CA--C 1.504 -0.82 0 O-C-N 123.813 0.696 . . . . 23.31 111.33 -176.358 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.28 137.49 43.02 Favored Glycine 0 N--CA 1.433 -1.506 0 C-N-CA 118.151 -1.976 . . . . 21.98 108.268 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.325 9.0 t80 -136.26 122.84 20.91 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 117.297 -1.335 . . . . 21.15 107.843 -177.046 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -151.23 160.83 43.61 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 120.719 1.6 . . . . 21.05 111.756 -176.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ILE . . . . . 0.476 ' CD1' ' CD1' ' A' ' 115' ' ' ILE . 22.2 mm -91.39 127.72 43.58 Favored 'Isoleucine or valine' 0 C--O 1.249 1.056 0 N-CA-C 102.447 -3.168 . . . . 20.03 102.447 174.31 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -102.21 164.09 11.88 Favored 'General case' 0 C--O 1.271 2.191 0 O-C-N 125.41 1.694 . . . . 21.92 108.086 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -66.06 -50.54 63.8 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 119.536 3.161 . . . . 47.24 119.536 -172.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -91.2 148.58 22.25 Favored 'General case' 0 C--N 1.363 1.184 0 O-C-N 125.94 2.025 . . . . 24.92 113.182 -173.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -78.74 52.46 3.91 Favored Glycine 0 C--O 1.172 -3.721 0 N-CA-C 109.636 -1.386 . . . . 20.46 109.636 177.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.5 t -150.41 148.58 28.95 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 120.212 2.006 . . . . 27.14 112.859 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . 0.657 ' N ' ' O ' ' A' ' 527' ' ' HOH . 90.7 m -118.02 9.45 12.76 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 124.902 1.281 . . . . 27.55 110.423 176.986 -70.213 -66.454 -74.972 104.429 2.028 104.818 -84.686 -174.293 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.09 171.78 12.27 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 119.386 -2.071 . . . . 27.59 110.848 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -81.77 170.12 16.1 Favored 'General case' 0 CA--C 1.491 -1.321 0 O-C-N 120.197 -1.564 . . . . 37.86 110.528 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' A SER . . . . . . . . . . . . . 54.3 p -137.48 -175.63 4.13 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 105.224 -2.139 . . . . 23.65 105.224 175.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' B GLU . . . . . 0.514 ' OE2' ' N ' ' A' ' 53' E GLY . 11.2 tm-20 -131.97 140.47 48.99 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 120.984 -1.073 . . . . 31.4 111.307 -178.423 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' C LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.33 107.4 4.52 Favored 'General case' 0 C--O 1.254 1.339 0 CA-C-O 122.452 1.12 . . . . 78.16 111.87 -179.022 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' D ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.64 44.89 20.02 Favored 'General case' 0 C--O 1.25 1.112 0 N-CA-C 115.949 1.833 . . . . 100.0 115.949 177.022 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' E GLY . . . . . 0.514 ' N ' ' OE2' ' A' ' 53' B GLU . . . 85.0 -4.98 84.53 Favored Glycine 0 N--CA 1.432 -1.575 0 CA-C-N 112.552 -2.113 . . . . 29.24 114.042 -179.078 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' F LYS . . . . . . . . . . . . . 17.8 mtpt -111.94 158.24 19.72 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 124.265 1.983 . . . . 100.0 116.097 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' G VAL . . . . . 0.426 ' N ' ' O ' ' A' ' 590' ' ' HOH . 39.6 t -85.62 137.25 21.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 C-N-CA 115.908 -2.317 . . . . 32.52 111.591 -178.503 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' H VAL . . . . . . . . . . . . . 97.8 t -112.76 92.92 2.24 Favored 'Isoleucine or valine' 0 C--N 1.358 0.935 0 CA-C-O 123.962 1.839 . . . . 30.15 114.167 176.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 mp -53.98 131.91 41.29 Favored 'General case' 0 C--O 1.193 -1.896 0 CA-C-N 114.726 -1.125 . . . . 31.84 110.491 -178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 66.5 3.14 18.48 Favored Glycine 0 CA--C 1.549 2.216 0 C-N-CA 123.589 0.614 . . . . 23.85 112.52 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.79 -23.24 29.22 Favored Glycine 0 C--O 1.191 -2.554 0 CA-C-O 119.614 -0.548 . . . . 21.35 112.374 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.07 -21.21 66.36 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 121.704 2.752 . . . . 25.22 116.155 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.32 -5.32 31.53 Favored 'General case' 0 N--CA 1.418 -2.051 0 O-C-N 120.043 -1.661 . . . . 18.72 112.463 -178.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.41 -157.02 49.13 Favored Glycine 0 C--O 1.267 2.211 0 C-N-CA 118.867 -1.635 . . . . 23.29 111.14 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -87.47 -169.38 45.54 Favored Glycine 0 C--N 1.361 1.949 0 CA-C-O 118.509 -1.162 . . . . 21.43 111.325 -176.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HIS . . . . . 0.432 ' CE1' ' CD2' ' A' ' 135' ' ' LEU . 32.5 m170 -65.6 147.38 53.5 Favored 'General case' 0 N--CA 1.519 2.992 0 CA-C-O 122.967 1.365 . . . . 26.99 112.891 177.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -60.53 129.08 39.82 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 117.708 -3.12 . . . . 20.09 106.234 177.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -148.22 60.7 5.32 Favored Pre-proline 0 N--CA 1.482 1.15 0 O-C-N 120.276 -1.515 . . . . 24.33 112.046 -175.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -56.78 -12.38 8.92 Favored 'Trans proline' 0 CA--C 1.552 1.392 0 O-C-N 123.046 1.024 . . . . 21.71 114.7 -178.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 73.6 mt-10 -107.96 7.84 28.12 Favored 'General case' 0 CA--C 1.502 -0.902 0 O-C-N 120.176 -1.578 . . . . 54.72 107.618 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 46.99 62.13 2.52 Favored 'General case' 0 N--CA 1.421 -1.892 0 C-N-CA 118.336 -1.346 . . . . 58.66 113.411 -179.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . 0.429 ' O ' ' CB ' ' A' ' 68' ' ' ASN . 78.8 p -85.11 -35.14 21.97 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 120.148 -1.595 . . . . 29.23 112.569 176.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . 0.429 ' CB ' ' O ' ' A' ' 67' ' ' THR . 57.2 t-20 69.03 20.37 7.78 Favored 'General case' 0 C--O 1.253 1.273 0 C-N-CA 118.031 -1.468 . . . . 39.63 112.371 -178.484 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' A LYS . . . . . . . . . . . . . 32.0 mttp -132.69 152.52 51.69 Favored 'General case' 0 C--O 1.268 2.047 0 CA-C-O 123.07 1.414 . . . . 61.33 108.825 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -105.43 133.05 50.83 Favored 'General case' 0 C--N 1.354 0.802 0 CA-C-N 114.843 -1.071 . . . . 23.26 111.038 177.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -153.22 -144.46 3.92 Favored Glycine 0 C--O 1.253 1.297 0 C-N-CA 115.825 -3.083 . . . . 18.35 115.027 -177.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -93.01 161.32 31.68 Favored Pre-proline 0 N--CA 1.495 1.81 0 C-N-CA 125.146 1.378 . . . . 19.85 112.779 -177.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -74.4 -10.7 22.39 Favored 'Trans proline' 0 C--O 1.198 -1.521 0 C-N-CA 116.398 -1.934 . . . . 22.71 114.135 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 6.9 p90 -121.22 17.18 11.53 Favored 'General case' 0 N--CA 1.433 -1.289 0 CA-C-O 118.701 -0.666 . . . . 21.57 111.347 -174.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.9 p -114.02 142.19 46.49 Favored 'General case' 0 C--O 1.262 1.735 0 N-CA-C 106.658 -1.608 . . . . 27.01 106.658 174.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . 0.293 74.5 m-20 -86.61 -32.54 20.56 Favored 'General case' 0 CA--C 1.485 -1.526 0 N-CA-C 119.07 2.989 . . . . 45.51 119.07 -172.558 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -86.35 45.11 1.2 Allowed 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 119.545 3.165 . . . . 61.98 119.545 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -151.09 178.16 9.48 Favored 'General case' 0 CA--C 1.48 -1.734 0 CA-C-O 115.582 -2.151 . . . . 26.43 105.602 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -48.46 135.44 14.11 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 115.856 1.798 . . . . 23.08 115.856 -175.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.32 -28.07 69.05 Favored 'General case' 0 N--CA 1.413 -2.291 0 CA-C-N 113.265 -1.789 . . . . 38.3 107.279 175.035 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -92.68 21.99 35.92 Favored Glycine 0 N--CA 1.502 3.04 0 C-N-CA 114.194 -3.86 . . . . 15.11 117.583 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -80.8 115.5 20.33 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 120.495 -1.591 . . . . 20.15 109.299 177.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.3 mt -110.3 166.45 10.75 Favored Pre-proline 0 C--N 1.305 -1.36 0 CA-C-O 124.303 2.002 . . . . 18.92 112.396 179.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.71 151.06 83.34 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 N-CA-C 106.258 -2.247 . . . . 18.21 106.258 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.13 147.03 53.64 Favored 'General case' 0 C--O 1.254 1.291 0 N-CA-C 113.946 1.091 . . . . 25.08 113.946 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.3 tp -92.69 117.14 29.68 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 116.297 1.962 . . . . 25.67 116.297 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -83.88 133.11 34.74 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 119.273 -2.142 . . . . 32.05 114.456 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . 0.61 ' N ' ' O ' ' A' ' 39' ' ' GLY . 79.6 t -117.5 125.98 74.38 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.397 0 CA-C-O 123.228 1.489 . . . . 20.45 110.691 178.58 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.89 165.56 10.55 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-O 123.884 1.802 . . . . 50.69 115.052 -178.825 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . 0.352 . . -46.29 -37.63 7.57 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 113.945 -1.48 . . . . 32.82 114.497 173.07 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.91 7.53 15.16 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.05 2.14 . . . . 54.57 113.075 176.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.82 8.25 86.17 Favored Glycine 0 C--O 1.254 1.395 0 C-N-CA 117.642 -2.218 . . . . 27.82 113.05 175.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.56 142.38 31.11 Favored 'General case' 0 C--O 1.255 1.382 0 CA-C-O 124.972 2.32 . . . . 30.09 117.192 178.354 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -120.84 112.98 19.49 Favored 'General case' 0 C--O 1.2 -1.532 0 CA-C-N 113.658 -1.61 . . . . 21.87 111.071 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 16.1 p -137.82 6.92 2.71 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 115.04 1.496 . . . . 31.02 115.04 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -87.84 116.62 66.74 Favored Pre-proline 0 N--CA 1.498 1.94 0 O-C-N 124.734 1.271 . . . . 34.01 108.946 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -73.64 151.12 46.37 Favored 'Trans proline' 0 C--O 1.265 1.848 0 C-N-CA 121.907 1.738 . . . . 30.68 112.287 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 17.6 m -133.92 153.17 35.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.931 0 CA-C-N 114.349 -1.296 . . . . 15.76 112.935 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 16.4 tp -109.28 138.51 45.53 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 113.548 0.944 . . . . 17.63 113.548 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -124.79 97.43 38.72 Favored Pre-proline 0 CA--C 1.511 -0.536 0 N-CA-C 104.989 -2.226 . . . . 19.44 104.989 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.56 -25.24 55.16 Favored 'Trans proline' 0 N--CA 1.414 -3.158 0 N-CA-C 115.097 1.153 . . . . 29.35 115.097 -171.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 32.0 mtm180 -86.03 -2.07 57.95 Favored 'General case' 0 C--O 1.186 -2.242 0 CA-C-O 114.936 -2.459 . . . . 66.01 115.593 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 76.1 mt -106.15 164.83 11.68 Favored 'General case' 0 CA--C 1.488 -1.406 0 CA-C-N 121.428 1.922 . . . . 29.72 113.108 -173.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 4.3 p -124.01 143.54 50.36 Favored 'General case' 0 C--O 1.256 1.404 0 O-C-N 126.618 2.449 . . . . 23.73 108.566 174.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.25 -43.25 82.79 Favored 'General case' 0 C--N 1.364 1.196 0 CA-C-O 122.546 1.165 . . . . 31.51 110.495 179.484 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -52.85 -45.62 67.46 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 126.81 3.195 . . . . 76.46 116.011 -179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -72.71 -12.96 61.23 Favored 'General case' 0 C--N 1.31 -1.119 0 O-C-N 118.605 -2.559 . . . . 24.3 113.638 -177.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 98.2 mt -77.84 -24.04 48.77 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 116.612 2.079 . . . . 24.82 116.612 -172.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -54.75 134.15 47.5 Favored 'General case' 0 C--O 1.257 1.456 0 CA-C-N 112.369 -2.196 . . . . 83.2 112.273 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 82.07 -2.34 84.34 Favored Glycine 0 C--O 1.264 1.993 0 C-N-CA 119.651 -1.262 . . . . 34.77 114.156 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 85.8 m-70 -96.02 -178.87 4.49 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 117.058 -1.857 . . . . 27.97 106.052 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -123.79 139.53 53.88 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 118.068 -0.968 . . . . 26.79 111.957 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ILE . . . . . 0.476 ' CD1' ' CD1' ' A' ' 45' ' ' ILE . 2.2 mm -98.52 131.54 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 N-CA-C 107.529 -1.285 . . . . 62.57 107.529 174.466 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 24.2 tpp -115.44 139.72 49.78 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 116.23 1.937 . . . . 18.08 116.23 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 80.4 mt -115.84 128.17 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 104.622 -2.362 . . . . 18.24 104.622 172.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -98.86 168.53 10.06 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 121.414 -0.804 . . . . 20.24 113.064 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.15 -44.84 44.55 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 112.927 0.714 . . . . 25.41 112.927 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -76.03 -178.18 43.97 Favored Glycine 0 C--N 1.361 1.952 0 O-C-N 126.881 2.613 . . . . 20.31 111.036 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -89.55 -158.01 33.79 Favored Glycine 0 CA--C 1.54 1.602 0 C-N-CA 124.506 1.05 . . . . 20.26 111.595 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -144.72 104.8 4.06 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 120.079 -1.836 . . . . 20.47 108.391 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -90.51 2.5 55.68 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.142 1.337 . . . . 33.87 113.093 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 48.0 m80 58.9 45.13 15.64 Favored 'General case' 0 C--O 1.247 0.924 0 N-CA-C 114.422 1.268 . . . . 26.63 114.422 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 22.7 t -159.7 162.5 35.04 Favored 'General case' 0 C--N 1.349 0.549 0 CA-C-N 112.831 -1.986 . . . . 23.19 108.466 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -94.38 -0.07 55.13 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 124.48 2.086 . . . . 34.65 106.786 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 5.9 mtm -123.36 144.04 42.83 Favored Pre-proline 0 C--O 1.265 1.91 0 O-C-N 118.312 -2.743 . . . . 31.41 111.773 173.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -84.34 -2.29 57.81 Favored 'Cis proline' 0 C--N 1.361 1.195 0 N-CA-C 116.754 1.79 . . . . 36.26 116.754 1.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.22 138.78 54.11 Favored 'General case' 0 C--O 1.257 1.46 0 N-CA-C 106.491 -1.67 . . . . 79.39 106.491 -179.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.05 160.57 4.74 Favored 'General case' 0 C--N 1.3 -1.552 0 C-N-CA 114.829 -2.748 . . . . 29.45 110.781 -179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . 0.432 ' CD2' ' CE1' ' A' ' 61' ' ' HIS . 10.8 mt 46.78 35.75 3.36 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 112.575 -2.102 . . . . 25.81 115.279 176.821 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 75.17 10.03 84.19 Favored Glycine 0 CA--C 1.545 1.956 0 N-CA-C 117.223 1.649 . . . . 25.16 117.223 178.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 75.38 20.11 78.99 Favored Glycine 0 CA--C 1.572 3.625 0 O-C-N 120.515 -1.58 . . . . 22.38 114.202 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -66.75 -33.82 85.44 Favored Glycine 0 CA--C 1.557 2.665 0 CA-C-N 120.516 2.158 . . . . 20.04 114.47 177.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 65.23 -134.18 36.48 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-N 114.858 -0.671 . . . . 20.82 112.781 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.28 157.51 6.3 Favored 'General case' 0 C--N 1.364 1.21 0 C-N-CA 123.252 0.621 . . . . 23.71 112.474 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -96.72 133.36 41.37 Favored 'General case' 0 C--O 1.251 1.133 0 N-CA-C 106.708 -1.59 . . . . 25.29 106.708 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 31.7 m -117.23 -26.4 2.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 C-N-CA 115.153 -2.619 . . . . 32.24 114.375 -177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . 0.342 . . -139.08 140.45 38.02 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 119.081 -1.048 . . . . 20.11 112.631 176.023 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' CYS . . . . . . . . . . . . . 48.7 t -141.8 152.38 43.66 Favored 'General case' 0 C--O 1.263 1.777 0 N-CA-C 116.177 1.917 . . . . 26.2 116.177 -175.288 -174.293 -84.686 -74.972 104.818 2.028 104.429 -66.454 -70.213 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -162.45 141.91 7.55 Favored Glycine 0 C--N 1.355 1.618 0 N-CA-C 106.471 -2.652 . . . . 27.78 106.471 178.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 70.1 t -90.34 127.42 42.88 Favored 'Isoleucine or valine' 0 C--O 1.246 0.92 0 C-N-CA 130.532 3.533 . . . . 28.86 112.061 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 3.5 mp -85.22 110.83 19.87 Favored 'Isoleucine or valine' 0 C--O 1.251 1.141 0 CA-C-O 122.702 1.239 . . . . 30.61 109.795 -176.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.504 -0.794 0 CA-C-N 112.52 -2.127 . . . . 78.37 108.946 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' IUM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 559' ' ' IUM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . 0.657 ' O ' ' N ' ' A' ' 51' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 590' ' ' HOH . . . . . 0.426 ' O ' ' N ' ' A' ' 53' G VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.501 -0.916 0 N-CA-C 113.324 0.861 . . . . 100.0 113.324 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -142.35 135.55 28.76 Favored 'General case' 0 C--O 1.201 -1.481 0 N-CA-C 106.744 -1.576 . . . . 69.23 106.744 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 15.3 mt -120.18 152.26 37.93 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.268 -1.52 . . . . 43.14 110.894 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 p -103.8 128.88 51.19 Favored 'General case' 0 N--CA 1.425 -1.686 0 O-C-N 127.103 2.752 . . . . 30.37 105.924 174.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.1 t -115.46 121.98 68.36 Favored 'Isoleucine or valine' 0 C--N 1.363 1.189 0 C-N-CA 127.053 2.141 . . . . 29.32 111.572 172.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.6 pttt -86.6 132.25 33.95 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 106.826 -1.546 . . . . 58.01 106.826 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 34.5 mmm -107.86 140.14 41.41 Favored 'General case' 0 N--CA 1.437 -1.098 0 O-C-N 124.708 1.255 . . . . 25.02 111.221 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.0 m -123.93 141.43 52.04 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 114.848 -1.069 . . . . 40.12 112.958 179.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' A ASP . . . . . . . . . . . . . 9.8 t70 -70.8 126.4 29.5 Favored 'General case' 0 CA--C 1.494 -1.189 0 CA-C-O 113.97 -2.919 . . . . 31.55 107.173 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' B LEU . . . . . . . . . . . . . 84.4 mt -75.41 -26.68 58.6 Favored 'General case' 0 C--N 1.355 0.808 0 O-C-N 126.508 2.38 . . . . 26.33 114.802 -175.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 mp0 -81.47 -48.2 12.18 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 112.86 -1.973 . . . . 60.38 112.806 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 49.1 p -88.45 -24.89 22.89 Favored 'General case' 0 C--O 1.2 -1.502 0 N-CA-C 116.131 1.9 . . . . 33.57 116.131 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.55 2.57 90.56 Favored Glycine 0 CA--C 1.564 3.121 0 CA-C-O 123.469 1.594 . . . . 31.61 113.594 -176.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -99.12 153.52 37.75 Favored Pre-proline 0 C--O 1.205 -1.28 0 O-C-N 119.034 -2.451 . . . . 83.16 111.553 -176.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -61.14 144.75 99.23 Favored 'Trans proline' 0 N--CA 1.43 -2.235 0 C-N-CA 121.415 1.41 . . . . 24.04 112.81 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.256 27.2 m -116.85 0.64 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 N-CA-C 116.869 2.174 . . . . 32.38 116.869 176.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.85 -150.9 16.84 Favored Glycine 0 C--O 1.211 -1.328 0 N-CA-C 109.065 -1.614 . . . . 21.49 109.065 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.9 p -146.74 168.84 20.37 Favored 'General case' 0 C--O 1.264 1.821 0 O-C-N 119.637 -2.096 . . . . 48.27 111.109 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 mt -130.25 130.21 65.5 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.875 0 N-CA-C 104.72 -2.326 . . . . 16.13 104.72 176.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.76 136.0 33.62 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 125.964 2.04 . . . . 100.0 110.182 178.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . 0.461 ' HB3' HD21 ' A' ' 107' ' ' LEU . 5.9 mp -112.71 131.22 55.76 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 117.696 -1.601 . . . . 27.73 109.922 -178.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.7 p -136.97 146.85 45.86 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 113.971 1.1 . . . . 42.45 113.971 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -99.09 137.76 37.15 Favored 'General case' 0 N--CA 1.419 -2.021 0 C-N-CA 116.009 -2.276 . . . . 40.63 111.342 -177.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . 0.428 0.9 OUTLIER -139.27 174.51 10.43 Favored 'General case' 0 N--CA 1.42 -1.938 0 C-N-CA 116.806 -1.958 . . . . 55.69 111.28 175.294 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . 0.848 ' HD3' ' CZ ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -57.84 -23.93 55.08 Favored 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 113.023 -1.899 . . . . 93.51 113.54 -179.849 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . 0.848 ' CZ ' ' HD3' ' A' ' 24' ' ' LYS . 81.7 m-85 -104.64 1.14 29.23 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 118.243 -1.383 . . . . 27.15 111.703 -177.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.84 -157.79 25.43 Favored Glycine 0 N--CA 1.47 0.925 0 O-C-N 119.461 -2.025 . . . . 20.69 110.951 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.5 t -98.68 129.63 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 112.684 0.624 . . . . 19.75 112.684 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.7 t -100.07 131.62 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 CA-C-O 122.487 1.136 . . . . 25.15 111.014 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -111.35 116.05 30.31 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 106.214 -1.772 . . . . 22.8 106.214 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.9 mp -112.85 105.47 55.79 Favored Pre-proline 0 CA--C 1.555 1.163 0 CA-C-O 122.817 1.294 . . . . 24.46 110.729 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -82.53 149.65 14.69 Favored 'Trans proline' 0 C--O 1.207 -1.061 0 C-N-CA 122.31 2.007 . . . . 21.8 114.09 -176.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . 0.527 ' HA ' ' OE1' ' A' ' 32' ' ' GLU . 13.0 mm-40 -138.82 74.03 1.46 Allowed 'General case' 0 C--O 1.189 -2.121 0 N-CA-C 103.788 -2.671 . . . . 100.0 103.788 172.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.5 mt -123.09 167.23 13.93 Favored 'General case' 0 N--CA 1.439 -1.021 0 O-C-N 124.592 1.182 . . . . 25.98 110.652 -174.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -162.78 166.35 24.34 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 103.647 -2.723 . . . . 30.05 103.647 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . 0.373 80.0 m-20 75.49 29.57 0.88 Allowed 'General case' 0 C--O 1.254 1.308 0 N-CA-C 114.413 1.264 . . . . 39.5 114.413 178.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 13.3 mt -118.27 174.55 6.16 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 114.798 -1.092 . . . . 33.14 109.165 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.8 p -93.88 125.73 52.01 Favored Pre-proline 0 C--O 1.257 1.48 0 CA-C-O 121.992 0.901 . . . . 34.34 113.428 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -50.68 141.09 35.66 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 CA-C-O 124.795 1.915 . . . . 29.25 113.041 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . 0.553 ' O ' ' N ' ' A' ' 87' ' ' VAL . . . 123.96 -162.56 17.96 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 111.946 -2.388 . . . . 29.35 111.035 -177.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' MET . . . . . 0.999 ' HE1' ' HB2' ' A' ' 86' ' ' PHE . 13.1 mmt -102.93 136.4 42.81 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 126.586 1.954 . . . . 31.34 107.652 -176.037 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -128.36 140.88 51.62 Favored 'General case' 0 CA--C 1.504 -0.82 0 O-C-N 123.813 0.696 . . . . 23.31 111.33 -176.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.28 137.49 43.02 Favored Glycine 0 N--CA 1.433 -1.506 0 C-N-CA 118.151 -1.976 . . . . 21.98 108.268 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.325 9.0 t80 -136.26 122.84 20.91 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 117.297 -1.335 . . . . 21.15 107.843 -177.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -151.23 160.83 43.61 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 120.719 1.6 . . . . 21.05 111.756 -176.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ILE . . . . . 0.86 HD13 HD13 ' A' ' 115' ' ' ILE . 22.2 mm -91.39 127.72 43.58 Favored 'Isoleucine or valine' 0 C--O 1.249 1.056 0 N-CA-C 102.447 -3.168 . . . . 20.03 102.447 174.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -102.21 164.09 11.88 Favored 'General case' 0 C--O 1.271 2.191 0 O-C-N 125.41 1.694 . . . . 21.92 108.086 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -66.06 -50.54 63.8 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 119.536 3.161 . . . . 47.24 119.536 -172.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -91.2 148.58 22.25 Favored 'General case' 0 C--N 1.363 1.184 0 O-C-N 125.94 2.025 . . . . 24.92 113.182 -173.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -78.74 52.46 3.91 Favored Glycine 0 C--O 1.172 -3.721 0 N-CA-C 109.636 -1.386 . . . . 20.46 109.636 177.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . 0.75 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 28.5 t -150.41 148.58 28.95 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 120.212 2.006 . . . . 27.14 112.859 -179.251 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 90.7 m -118.02 9.45 12.76 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 124.902 1.281 . . . . 27.55 110.423 176.986 -70.213 -66.454 -74.972 104.429 2.028 104.818 -84.686 -174.293 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.09 171.78 12.27 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 119.386 -2.071 . . . . 27.59 110.848 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -81.77 170.12 16.1 Favored 'General case' 0 CA--C 1.491 -1.321 0 O-C-N 120.197 -1.564 . . . . 37.86 110.528 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' A SER . . . . . . . . . . . . . 54.3 p -137.48 -175.63 4.13 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 105.224 -2.139 . . . . 23.65 105.224 175.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' B GLU . . . . . . . . . . . . . 11.2 tm-20 -131.97 140.47 48.99 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 120.984 -1.073 . . . . 31.4 111.307 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' C LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.33 107.4 4.52 Favored 'General case' 0 C--O 1.254 1.339 0 CA-C-O 122.452 1.12 . . . . 78.16 111.87 -179.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' D ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.64 44.89 20.02 Favored 'General case' 0 C--O 1.25 1.112 0 N-CA-C 115.949 1.833 . . . . 100.0 115.949 177.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' E GLY . . . . . . . . . . . . . . . 85.0 -4.98 84.53 Favored Glycine 0 N--CA 1.432 -1.575 0 CA-C-N 112.552 -2.113 . . . . 29.24 114.042 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' F LYS . . . . . . . . . . . . . 17.8 mtpt -111.94 158.24 19.72 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 124.265 1.983 . . . . 100.0 116.097 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' G VAL . . . . . . . . . . . . . 39.6 t -85.62 137.25 21.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 C-N-CA 115.908 -2.317 . . . . 32.52 111.591 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' H VAL . . . . . . . . . . . . . 97.8 t -112.76 92.92 2.24 Favored 'Isoleucine or valine' 0 C--N 1.358 0.935 0 CA-C-O 123.962 1.839 . . . . 30.15 114.167 176.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 mp -53.98 131.91 41.29 Favored 'General case' 0 C--O 1.193 -1.896 0 CA-C-N 114.726 -1.125 . . . . 31.84 110.491 -178.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 66.5 3.14 18.48 Favored Glycine 0 CA--C 1.549 2.216 0 C-N-CA 123.589 0.614 . . . . 23.85 112.52 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.79 -23.24 29.22 Favored Glycine 0 C--O 1.191 -2.554 0 CA-C-O 119.614 -0.548 . . . . 21.35 112.374 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.07 -21.21 66.36 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 121.704 2.752 . . . . 25.22 116.155 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . 0.75 ' HB2' ' O ' ' A' ' 50' ' ' SER . . . -71.32 -5.32 31.53 Favored 'General case' 0 N--CA 1.418 -2.051 0 O-C-N 120.043 -1.661 . . . . 18.72 112.463 -178.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.41 -157.02 49.13 Favored Glycine 0 C--O 1.267 2.211 0 C-N-CA 118.867 -1.635 . . . . 23.29 111.14 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -87.47 -169.38 45.54 Favored Glycine 0 C--N 1.361 1.949 0 CA-C-O 118.509 -1.162 . . . . 21.43 111.325 -176.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HIS . . . . . 0.511 ' CE1' HD22 ' A' ' 135' ' ' LEU . 32.5 m170 -65.6 147.38 53.5 Favored 'General case' 0 N--CA 1.519 2.992 0 CA-C-O 122.967 1.365 . . . . 26.99 112.891 177.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -60.53 129.08 39.82 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 117.708 -3.12 . . . . 20.09 106.234 177.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -148.22 60.7 5.32 Favored Pre-proline 0 N--CA 1.482 1.15 0 O-C-N 120.276 -1.515 . . . . 24.33 112.046 -175.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PRO . . . . . 0.55 ' HD2' ' HB2' ' A' ' 79' ' ' LYS . 40.0 Cg_endo -56.78 -12.38 8.92 Favored 'Trans proline' 0 CA--C 1.552 1.392 0 O-C-N 123.046 1.024 . . . . 21.71 114.7 -178.05 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 73.6 mt-10 -107.96 7.84 28.12 Favored 'General case' 0 CA--C 1.502 -0.902 0 O-C-N 120.176 -1.578 . . . . 54.72 107.618 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 46.99 62.13 2.52 Favored 'General case' 0 N--CA 1.421 -1.892 0 C-N-CA 118.336 -1.346 . . . . 58.66 113.411 -179.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . 0.599 ' O ' ' HB3' ' A' ' 68' ' ' ASN . 78.8 p -85.11 -35.14 21.97 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 120.148 -1.595 . . . . 29.23 112.569 176.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . 0.599 ' HB3' ' O ' ' A' ' 67' ' ' THR . 57.2 t-20 69.03 20.37 7.78 Favored 'General case' 0 C--O 1.253 1.273 0 C-N-CA 118.031 -1.468 . . . . 39.63 112.371 -178.484 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' A LYS . . . . . . . . . . . . . 32.0 mttp -132.69 152.52 51.69 Favored 'General case' 0 C--O 1.268 2.047 0 CA-C-O 123.07 1.414 . . . . 61.33 108.825 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -105.43 133.05 50.83 Favored 'General case' 0 C--N 1.354 0.802 0 CA-C-N 114.843 -1.071 . . . . 23.26 111.038 177.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -153.22 -144.46 3.92 Favored Glycine 0 C--O 1.253 1.297 0 C-N-CA 115.825 -3.083 . . . . 18.35 115.027 -177.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -93.01 161.32 31.68 Favored Pre-proline 0 N--CA 1.495 1.81 0 C-N-CA 125.146 1.378 . . . . 19.85 112.779 -177.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -74.4 -10.7 22.39 Favored 'Trans proline' 0 C--O 1.198 -1.521 0 C-N-CA 116.398 -1.934 . . . . 22.71 114.135 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 6.9 p90 -121.22 17.18 11.53 Favored 'General case' 0 N--CA 1.433 -1.289 0 CA-C-O 118.701 -0.666 . . . . 21.57 111.347 -174.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.9 p -114.02 142.19 46.49 Favored 'General case' 0 C--O 1.262 1.735 0 N-CA-C 106.658 -1.608 . . . . 27.01 106.658 174.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . 0.293 74.5 m-20 -86.61 -32.54 20.56 Favored 'General case' 0 CA--C 1.485 -1.526 0 N-CA-C 119.07 2.989 . . . . 45.51 119.07 -172.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -86.35 45.11 1.2 Allowed 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 119.545 3.165 . . . . 61.98 119.545 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -151.09 178.16 9.48 Favored 'General case' 0 CA--C 1.48 -1.734 0 CA-C-O 115.582 -2.151 . . . . 26.43 105.602 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -48.46 135.44 14.11 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 115.856 1.798 . . . . 23.08 115.856 -175.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . 0.55 ' HB2' ' HD2' ' A' ' 64' ' ' PRO . 0.1 OUTLIER -65.32 -28.07 69.05 Favored 'General case' 0 N--CA 1.413 -2.291 0 CA-C-N 113.265 -1.789 . . . . 38.3 107.279 175.035 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -92.68 21.99 35.92 Favored Glycine 0 N--CA 1.502 3.04 0 C-N-CA 114.194 -3.86 . . . . 15.11 117.583 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -80.8 115.5 20.33 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 120.495 -1.591 . . . . 20.15 109.299 177.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.3 mt -110.3 166.45 10.75 Favored Pre-proline 0 C--N 1.305 -1.36 0 CA-C-O 124.303 2.002 . . . . 18.92 112.396 179.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.71 151.06 83.34 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 N-CA-C 106.258 -2.247 . . . . 18.21 106.258 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.13 147.03 53.64 Favored 'General case' 0 C--O 1.254 1.291 0 N-CA-C 113.946 1.091 . . . . 25.08 113.946 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.3 tp -92.69 117.14 29.68 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 116.297 1.962 . . . . 25.67 116.297 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . 0.999 ' HB2' ' HE1' ' A' ' 40' ' ' MET . 59.0 t80 -83.88 133.11 34.74 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 119.273 -2.142 . . . . 32.05 114.456 -177.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 39' ' ' GLY . 79.6 t -117.5 125.98 74.38 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.397 0 CA-C-O 123.228 1.489 . . . . 20.45 110.691 178.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.89 165.56 10.55 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-O 123.884 1.802 . . . . 50.69 115.052 -178.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . 0.352 . . -46.29 -37.63 7.57 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 113.945 -1.48 . . . . 32.82 114.497 173.07 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 39.6 p30 -82.91 7.53 15.16 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.05 2.14 . . . . 54.57 113.075 176.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.82 8.25 86.17 Favored Glycine 0 C--O 1.254 1.395 0 C-N-CA 117.642 -2.218 . . . . 27.82 113.05 175.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.56 142.38 31.11 Favored 'General case' 0 C--O 1.255 1.382 0 CA-C-O 124.972 2.32 . . . . 30.09 117.192 178.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -120.84 112.98 19.49 Favored 'General case' 0 C--O 1.2 -1.532 0 CA-C-N 113.658 -1.61 . . . . 21.87 111.071 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 16.1 p -137.82 6.92 2.71 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 115.04 1.496 . . . . 31.02 115.04 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 594' ' ' HOH . 7.4 t-20 -87.84 116.62 66.74 Favored Pre-proline 0 N--CA 1.498 1.94 0 O-C-N 124.734 1.271 . . . . 34.01 108.946 -178.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -73.64 151.12 46.37 Favored 'Trans proline' 0 C--O 1.265 1.848 0 C-N-CA 121.907 1.738 . . . . 30.68 112.287 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 17.6 m -133.92 153.17 35.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.931 0 CA-C-N 114.349 -1.296 . . . . 15.76 112.935 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 16.4 tp -109.28 138.51 45.53 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 113.548 0.944 . . . . 17.63 113.548 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -124.79 97.43 38.72 Favored Pre-proline 0 CA--C 1.511 -0.536 0 N-CA-C 104.989 -2.226 . . . . 19.44 104.989 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.56 -25.24 55.16 Favored 'Trans proline' 0 N--CA 1.414 -3.158 0 N-CA-C 115.097 1.153 . . . . 29.35 115.097 -171.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 32.0 mtm180 -86.03 -2.07 57.95 Favored 'General case' 0 C--O 1.186 -2.242 0 CA-C-O 114.936 -2.459 . . . . 66.01 115.593 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 76.1 mt -106.15 164.83 11.68 Favored 'General case' 0 CA--C 1.488 -1.406 0 CA-C-N 121.428 1.922 . . . . 29.72 113.108 -173.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' THR . . . . . 0.401 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 4.3 p -124.01 143.54 50.36 Favored 'General case' 0 C--O 1.256 1.404 0 O-C-N 126.618 2.449 . . . . 23.73 108.566 174.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . 0.461 HD21 ' HB3' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -57.25 -43.25 82.79 Favored 'General case' 0 C--N 1.364 1.196 0 CA-C-O 122.546 1.165 . . . . 31.51 110.495 179.484 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -52.85 -45.62 67.46 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 126.81 3.195 . . . . 76.46 116.011 -179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 103' ' ' THR . 13.4 pt-20 -72.71 -12.96 61.23 Favored 'General case' 0 C--N 1.31 -1.119 0 O-C-N 118.605 -2.559 . . . . 24.3 113.638 -177.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 98.2 mt -77.84 -24.04 48.77 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 116.612 2.079 . . . . 24.82 116.612 -172.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -54.75 134.15 47.5 Favored 'General case' 0 C--O 1.257 1.456 0 CA-C-N 112.369 -2.196 . . . . 83.2 112.273 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 82.07 -2.34 84.34 Favored Glycine 0 C--O 1.264 1.993 0 C-N-CA 119.651 -1.262 . . . . 34.77 114.156 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 85.8 m-70 -96.02 -178.87 4.49 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 117.058 -1.857 . . . . 27.97 106.052 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -123.79 139.53 53.88 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 118.068 -0.968 . . . . 26.79 111.957 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ILE . . . . . 0.86 HD13 HD13 ' A' ' 45' ' ' ILE . 2.2 mm -98.52 131.54 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 N-CA-C 107.529 -1.285 . . . . 62.57 107.529 174.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 24.2 tpp -115.44 139.72 49.78 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 116.23 1.937 . . . . 18.08 116.23 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 80.4 mt -115.84 128.17 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 104.622 -2.362 . . . . 18.24 104.622 172.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -98.86 168.53 10.06 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 121.414 -0.804 . . . . 20.24 113.064 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.15 -44.84 44.55 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 112.927 0.714 . . . . 25.41 112.927 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -76.03 -178.18 43.97 Favored Glycine 0 C--N 1.361 1.952 0 O-C-N 126.881 2.613 . . . . 20.31 111.036 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -89.55 -158.01 33.79 Favored Glycine 0 CA--C 1.54 1.602 0 C-N-CA 124.506 1.05 . . . . 20.26 111.595 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -144.72 104.8 4.06 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 120.079 -1.836 . . . . 20.47 108.391 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -90.51 2.5 55.68 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.142 1.337 . . . . 33.87 113.093 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 58.9 45.13 15.64 Favored 'General case' 0 C--O 1.247 0.924 0 N-CA-C 114.422 1.268 . . . . 26.63 114.422 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 22.7 t -159.7 162.5 35.04 Favored 'General case' 0 C--N 1.349 0.549 0 CA-C-N 112.831 -1.986 . . . . 23.19 108.466 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -94.38 -0.07 55.13 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 124.48 2.086 . . . . 34.65 106.786 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 5.9 mtm -123.36 144.04 42.83 Favored Pre-proline 0 C--O 1.265 1.91 0 O-C-N 118.312 -2.743 . . . . 31.41 111.773 173.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -84.34 -2.29 57.81 Favored 'Cis proline' 0 C--N 1.361 1.195 0 N-CA-C 116.754 1.79 . . . . 36.26 116.754 1.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.22 138.78 54.11 Favored 'General case' 0 C--O 1.257 1.46 0 N-CA-C 106.491 -1.67 . . . . 79.39 106.491 -179.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.05 160.57 4.74 Favored 'General case' 0 C--N 1.3 -1.552 0 C-N-CA 114.829 -2.748 . . . . 29.45 110.781 -179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . 0.511 HD22 ' CE1' ' A' ' 61' ' ' HIS . 10.8 mt 46.78 35.75 3.36 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 112.575 -2.102 . . . . 25.81 115.279 176.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 75.17 10.03 84.19 Favored Glycine 0 CA--C 1.545 1.956 0 N-CA-C 117.223 1.649 . . . . 25.16 117.223 178.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 75.38 20.11 78.99 Favored Glycine 0 CA--C 1.572 3.625 0 O-C-N 120.515 -1.58 . . . . 22.38 114.202 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -66.75 -33.82 85.44 Favored Glycine 0 CA--C 1.557 2.665 0 CA-C-N 120.516 2.158 . . . . 20.04 114.47 177.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 65.23 -134.18 36.48 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-N 114.858 -0.671 . . . . 20.82 112.781 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.28 157.51 6.3 Favored 'General case' 0 C--N 1.364 1.21 0 C-N-CA 123.252 0.621 . . . . 23.71 112.474 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -96.72 133.36 41.37 Favored 'General case' 0 C--O 1.251 1.133 0 N-CA-C 106.708 -1.59 . . . . 25.29 106.708 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 31.7 m -117.23 -26.4 2.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 C-N-CA 115.153 -2.619 . . . . 32.24 114.375 -177.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . 0.342 . . -139.08 140.45 38.02 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 119.081 -1.048 . . . . 20.11 112.631 176.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' CYS . . . . . . . . . . . . . 48.7 t -141.8 152.38 43.66 Favored 'General case' 0 C--O 1.263 1.777 0 N-CA-C 116.177 1.917 . . . . 26.2 116.177 -175.288 -174.293 -84.686 -74.972 104.818 2.028 104.429 -66.454 -70.213 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -162.45 141.91 7.55 Favored Glycine 0 C--N 1.355 1.618 0 N-CA-C 106.471 -2.652 . . . . 27.78 106.471 178.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 70.1 t -90.34 127.42 42.88 Favored 'Isoleucine or valine' 0 C--O 1.246 0.92 0 C-N-CA 130.532 3.533 . . . . 28.86 112.061 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 3.5 mp -85.22 110.83 19.87 Favored 'Isoleucine or valine' 0 C--O 1.251 1.141 0 CA-C-O 122.702 1.239 . . . . 30.61 109.795 -176.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.504 -0.794 0 CA-C-N 112.52 -2.127 . . . . 78.37 108.946 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' IUM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 559' ' ' IUM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 594' ' ' HOH . . . . . 0.526 ' O ' ' HB2' ' A' ' 95' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.501 -0.916 0 N-CA-C 113.324 0.861 . . . . 100.0 113.324 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -142.35 135.55 28.76 Favored 'General case' 0 C--O 1.201 -1.481 0 N-CA-C 106.744 -1.576 . . . . 69.23 106.744 177.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 15.3 mt -120.18 152.26 37.93 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 120.268 -1.52 . . . . 43.14 110.894 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 16.7 p -103.8 128.88 51.19 Favored 'General case' 0 N--CA 1.425 -1.686 0 O-C-N 127.103 2.752 . . . . 30.37 105.924 174.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.1 t -115.46 121.98 68.36 Favored 'Isoleucine or valine' 0 C--N 1.363 1.189 0 C-N-CA 127.053 2.141 . . . . 29.32 111.572 172.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.6 pttt -86.6 132.25 33.95 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 106.826 -1.546 . . . . 58.01 106.826 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 34.5 mmm -107.86 140.14 41.41 Favored 'General case' 0 N--CA 1.437 -1.098 0 O-C-N 124.708 1.255 . . . . 25.02 111.221 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.0 m -123.93 141.43 52.04 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 114.848 -1.069 . . . . 40.12 112.958 179.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' A ASP . . . . . . . . . . . . . 9.8 t70 -70.8 126.4 29.5 Favored 'General case' 0 CA--C 1.494 -1.189 0 CA-C-O 113.97 -2.919 . . . . 31.55 107.173 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' B LEU . . . . . . . . . . . . . 84.4 mt -75.41 -26.68 58.6 Favored 'General case' 0 C--N 1.355 0.808 0 O-C-N 126.508 2.38 . . . . 26.33 114.802 -175.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 mp0 -81.47 -48.2 12.18 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 112.86 -1.973 . . . . 60.38 112.806 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 49.1 p -88.45 -24.89 22.89 Favored 'General case' 0 C--O 1.2 -1.502 0 N-CA-C 116.131 1.9 . . . . 33.57 116.131 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.55 2.57 90.56 Favored Glycine 0 CA--C 1.564 3.121 0 CA-C-O 123.469 1.594 . . . . 31.61 113.594 -176.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -99.12 153.52 37.75 Favored Pre-proline 0 C--O 1.205 -1.28 0 O-C-N 119.034 -2.451 . . . . 83.16 111.553 -176.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -61.14 144.75 99.23 Favored 'Trans proline' 0 N--CA 1.43 -2.235 0 C-N-CA 121.415 1.41 . . . . 24.04 112.81 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . 0.256 27.2 m -116.85 0.64 8.33 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 N-CA-C 116.869 2.174 . . . . 32.38 116.869 176.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.85 -150.9 16.84 Favored Glycine 0 C--O 1.211 -1.328 0 N-CA-C 109.065 -1.614 . . . . 21.49 109.065 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.9 p -146.74 168.84 20.37 Favored 'General case' 0 C--O 1.264 1.821 0 O-C-N 119.637 -2.096 . . . . 48.27 111.109 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 mt -130.25 130.21 65.5 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.875 0 N-CA-C 104.72 -2.326 . . . . 16.13 104.72 176.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.76 136.0 33.62 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 125.964 2.04 . . . . 100.0 110.182 178.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.461 ' HB3' HD21 ' A' ' 107' ' ' LEU . 5.9 mp -112.71 131.22 55.76 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 117.696 -1.601 . . . . 27.73 109.922 -178.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.7 p -136.97 146.85 45.86 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 113.971 1.1 . . . . 42.45 113.971 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.421 ' NE2' ' H ' ' A' ' 107' ' ' LEU . 1.8 tp-100 -99.09 137.76 37.15 Favored 'General case' 0 N--CA 1.419 -2.021 0 C-N-CA 116.009 -2.276 . . . . 40.63 111.342 -177.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . 0.428 0.9 OUTLIER -139.27 174.51 10.43 Favored 'General case' 0 N--CA 1.42 -1.938 0 C-N-CA 116.806 -1.958 . . . . 55.69 111.28 175.294 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.848 ' HD3' ' CZ ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -57.84 -23.93 55.08 Favored 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 113.023 -1.899 . . . . 93.51 113.54 -179.849 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.848 ' CZ ' ' HD3' ' A' ' 24' ' ' LYS . 81.7 m-85 -104.64 1.14 29.23 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 118.243 -1.383 . . . . 27.15 111.703 -177.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.84 -157.79 25.43 Favored Glycine 0 N--CA 1.47 0.925 0 O-C-N 119.461 -2.025 . . . . 20.69 110.951 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.5 t -98.68 129.63 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 N-CA-C 112.684 0.624 . . . . 19.75 112.684 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.7 t -100.07 131.62 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 CA-C-O 122.487 1.136 . . . . 25.15 111.014 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -111.35 116.05 30.31 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 106.214 -1.772 . . . . 22.8 106.214 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.9 mp -112.85 105.47 55.79 Favored Pre-proline 0 CA--C 1.555 1.163 0 CA-C-O 122.817 1.294 . . . . 24.46 110.729 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -82.53 149.65 14.69 Favored 'Trans proline' 0 C--O 1.207 -1.061 0 C-N-CA 122.31 2.007 . . . . 21.8 114.09 -176.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.527 ' HA ' ' OE1' ' A' ' 32' ' ' GLU . 13.0 mm-40 -138.82 74.03 1.46 Allowed 'General case' 0 C--O 1.189 -2.121 0 N-CA-C 103.788 -2.671 . . . . 100.0 103.788 172.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.5 mt -123.09 167.23 13.93 Favored 'General case' 0 N--CA 1.439 -1.021 0 O-C-N 124.592 1.182 . . . . 25.98 110.652 -174.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -162.78 166.35 24.34 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 103.647 -2.723 . . . . 30.05 103.647 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . 0.373 80.0 m-20 75.49 29.57 0.88 Allowed 'General case' 0 C--O 1.254 1.308 0 N-CA-C 114.413 1.264 . . . . 39.5 114.413 178.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 13.3 mt -118.27 174.55 6.16 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 114.798 -1.092 . . . . 33.14 109.165 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.8 p -93.88 125.73 52.01 Favored Pre-proline 0 C--O 1.257 1.48 0 CA-C-O 121.992 0.901 . . . . 34.34 113.428 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -50.68 141.09 35.66 Favored 'Trans proline' 0 N--CA 1.45 -1.036 0 CA-C-O 124.795 1.915 . . . . 29.25 113.041 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.553 ' O ' ' N ' ' A' ' 87' ' ' VAL . . . 123.96 -162.56 17.96 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 111.946 -2.388 . . . . 29.35 111.035 -177.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' MET . . . . . 0.999 ' HE1' ' HB2' ' A' ' 86' ' ' PHE . 13.1 mmt -102.93 136.4 42.81 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 126.586 1.954 . . . . 31.34 107.652 -176.037 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -128.36 140.88 51.62 Favored 'General case' 0 CA--C 1.504 -0.82 0 O-C-N 123.813 0.696 . . . . 23.31 111.33 -176.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.28 137.49 43.02 Favored Glycine 0 N--CA 1.433 -1.506 0 C-N-CA 118.151 -1.976 . . . . 21.98 108.268 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.325 9.0 t80 -136.26 122.84 20.91 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 117.297 -1.335 . . . . 21.15 107.843 -177.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -151.23 160.83 43.61 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 120.719 1.6 . . . . 21.05 111.756 -176.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.86 HD13 HD13 ' A' ' 115' ' ' ILE . 22.2 mm -91.39 127.72 43.58 Favored 'Isoleucine or valine' 0 C--O 1.249 1.056 0 N-CA-C 102.447 -3.168 . . . . 20.03 102.447 174.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -102.21 164.09 11.88 Favored 'General case' 0 C--O 1.271 2.191 0 O-C-N 125.41 1.694 . . . . 21.92 108.086 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -66.06 -50.54 63.8 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 119.536 3.161 . . . . 47.24 119.536 -172.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -91.2 148.58 22.25 Favored 'General case' 0 C--N 1.363 1.184 0 O-C-N 125.94 2.025 . . . . 24.92 113.182 -173.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -78.74 52.46 3.91 Favored Glycine 0 C--O 1.172 -3.721 0 N-CA-C 109.636 -1.386 . . . . 20.46 109.636 177.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . 0.75 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 28.5 t -150.41 148.58 28.95 Favored 'General case' 0 N--CA 1.432 -1.325 0 CA-C-N 120.212 2.006 . . . . 27.14 112.859 -179.251 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 90.7 m -118.02 9.45 12.76 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 124.902 1.281 . . . . 27.55 110.423 176.986 -70.213 -66.454 -74.972 104.429 2.028 104.818 -84.686 -174.293 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.09 171.78 12.27 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 119.386 -2.071 . . . . 27.59 110.848 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -81.77 170.12 16.1 Favored 'General case' 0 CA--C 1.491 -1.321 0 O-C-N 120.197 -1.564 . . . . 37.86 110.528 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' A SER . . . . . . . . . . . . . 54.3 p -137.48 -175.63 4.13 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 105.224 -2.139 . . . . 23.65 105.224 175.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' B GLU . . . . . . . . . . . . . 11.2 tm-20 -131.97 140.47 48.99 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 120.984 -1.073 . . . . 31.4 111.307 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' C LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.33 107.4 4.52 Favored 'General case' 0 C--O 1.254 1.339 0 CA-C-O 122.452 1.12 . . . . 78.16 111.87 -179.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' D ASP . . . . . . . . . . . . . 0.6 OUTLIER 57.64 44.89 20.02 Favored 'General case' 0 C--O 1.25 1.112 0 N-CA-C 115.949 1.833 . . . . 100.0 115.949 177.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' E GLY . . . . . . . . . . . . . . . 85.0 -4.98 84.53 Favored Glycine 0 N--CA 1.432 -1.575 0 CA-C-N 112.552 -2.113 . . . . 29.24 114.042 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' F LYS . . . . . . . . . . . . . 17.8 mtpt -111.94 158.24 19.72 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 124.265 1.983 . . . . 100.0 116.097 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' G VAL . . . . . . . . . . . . . 39.6 t -85.62 137.25 21.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 C-N-CA 115.908 -2.317 . . . . 32.52 111.591 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' H VAL . . . . . . . . . . . . . 97.8 t -112.76 92.92 2.24 Favored 'Isoleucine or valine' 0 C--N 1.358 0.935 0 CA-C-O 123.962 1.839 . . . . 30.15 114.167 176.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 mp -53.98 131.91 41.29 Favored 'General case' 0 C--O 1.193 -1.896 0 CA-C-N 114.726 -1.125 . . . . 31.84 110.491 -178.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 66.5 3.14 18.48 Favored Glycine 0 CA--C 1.549 2.216 0 C-N-CA 123.589 0.614 . . . . 23.85 112.52 -179.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.79 -23.24 29.22 Favored Glycine 0 C--O 1.191 -2.554 0 CA-C-O 119.614 -0.548 . . . . 21.35 112.374 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.07 -21.21 66.36 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 121.704 2.752 . . . . 25.22 116.155 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.75 ' HB2' ' O ' ' A' ' 50' ' ' SER . . . -71.32 -5.32 31.53 Favored 'General case' 0 N--CA 1.418 -2.051 0 O-C-N 120.043 -1.661 . . . . 18.72 112.463 -178.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 75.41 -157.02 49.13 Favored Glycine 0 C--O 1.267 2.211 0 C-N-CA 118.867 -1.635 . . . . 23.29 111.14 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -87.47 -169.38 45.54 Favored Glycine 0 C--N 1.361 1.949 0 CA-C-O 118.509 -1.162 . . . . 21.43 111.325 -176.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.511 ' CE1' HD22 ' A' ' 135' ' ' LEU . 32.5 m170 -65.6 147.38 53.5 Favored 'General case' 0 N--CA 1.519 2.992 0 CA-C-O 122.967 1.365 . . . . 26.99 112.891 177.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -60.53 129.08 39.82 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 117.708 -3.12 . . . . 20.09 106.234 177.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -148.22 60.7 5.32 Favored Pre-proline 0 N--CA 1.482 1.15 0 O-C-N 120.276 -1.515 . . . . 24.33 112.046 -175.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.55 ' HD2' ' HB2' ' A' ' 79' ' ' LYS . 40.0 Cg_endo -56.78 -12.38 8.92 Favored 'Trans proline' 0 CA--C 1.552 1.392 0 O-C-N 123.046 1.024 . . . . 21.71 114.7 -178.05 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 73.6 mt-10 -107.96 7.84 28.12 Favored 'General case' 0 CA--C 1.502 -0.902 0 O-C-N 120.176 -1.578 . . . . 54.72 107.618 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 46.99 62.13 2.52 Favored 'General case' 0 N--CA 1.421 -1.892 0 C-N-CA 118.336 -1.346 . . . . 58.66 113.411 -179.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . 0.599 ' O ' ' HB3' ' A' ' 68' ' ' ASN . 78.8 p -85.11 -35.14 21.97 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 120.148 -1.595 . . . . 29.23 112.569 176.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.599 ' HB3' ' O ' ' A' ' 67' ' ' THR . 57.2 t-20 69.03 20.37 7.78 Favored 'General case' 0 C--O 1.253 1.273 0 C-N-CA 118.031 -1.468 . . . . 39.63 112.371 -178.484 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' A LYS . . . . . . . . . . . . . 32.0 mttp -132.69 152.52 51.69 Favored 'General case' 0 C--O 1.268 2.047 0 CA-C-O 123.07 1.414 . . . . 61.33 108.825 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -105.43 133.05 50.83 Favored 'General case' 0 C--N 1.354 0.802 0 CA-C-N 114.843 -1.071 . . . . 23.26 111.038 177.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.417 ' O ' ' HD2' ' A' ' 124' ' ' HIS . . . -153.22 -144.46 3.92 Favored Glycine 0 C--O 1.253 1.297 0 C-N-CA 115.825 -3.083 . . . . 18.35 115.027 -177.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -93.01 161.32 31.68 Favored Pre-proline 0 N--CA 1.495 1.81 0 C-N-CA 125.146 1.378 . . . . 19.85 112.779 -177.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -74.4 -10.7 22.39 Favored 'Trans proline' 0 C--O 1.198 -1.521 0 C-N-CA 116.398 -1.934 . . . . 22.71 114.135 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 6.9 p90 -121.22 17.18 11.53 Favored 'General case' 0 N--CA 1.433 -1.289 0 CA-C-O 118.701 -0.666 . . . . 21.57 111.347 -174.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.9 p -114.02 142.19 46.49 Favored 'General case' 0 C--O 1.262 1.735 0 N-CA-C 106.658 -1.608 . . . . 27.01 106.658 174.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . 0.293 74.5 m-20 -86.61 -32.54 20.56 Favored 'General case' 0 CA--C 1.485 -1.526 0 N-CA-C 119.07 2.989 . . . . 45.51 119.07 -172.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -86.35 45.11 1.2 Allowed 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 119.545 3.165 . . . . 61.98 119.545 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -151.09 178.16 9.48 Favored 'General case' 0 CA--C 1.48 -1.734 0 CA-C-O 115.582 -2.151 . . . . 26.43 105.602 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -48.46 135.44 14.11 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 115.856 1.798 . . . . 23.08 115.856 -175.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.55 ' HB2' ' HD2' ' A' ' 64' ' ' PRO . 0.1 OUTLIER -65.32 -28.07 69.05 Favored 'General case' 0 N--CA 1.413 -2.291 0 CA-C-N 113.265 -1.789 . . . . 38.3 107.279 175.035 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -92.68 21.99 35.92 Favored Glycine 0 N--CA 1.502 3.04 0 C-N-CA 114.194 -3.86 . . . . 15.11 117.583 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -80.8 115.5 20.33 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 120.495 -1.591 . . . . 20.15 109.299 177.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.3 mt -110.3 166.45 10.75 Favored Pre-proline 0 C--N 1.305 -1.36 0 CA-C-O 124.303 2.002 . . . . 18.92 112.396 179.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -66.71 151.06 83.34 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 N-CA-C 106.258 -2.247 . . . . 18.21 106.258 177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -67.13 147.03 53.64 Favored 'General case' 0 C--O 1.254 1.291 0 N-CA-C 113.946 1.091 . . . . 25.08 113.946 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.3 tp -92.69 117.14 29.68 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 116.297 1.962 . . . . 25.67 116.297 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.999 ' HB2' ' HE1' ' A' ' 40' ' ' MET . 59.0 t80 -83.88 133.11 34.74 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 119.273 -2.142 . . . . 32.05 114.456 -177.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.553 ' N ' ' O ' ' A' ' 39' ' ' GLY . 79.6 t -117.5 125.98 74.38 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.397 0 CA-C-O 123.228 1.489 . . . . 20.45 110.691 178.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . 0.553 ' HB2' ' ND2' ' A' ' 90' ' ' ASN . 0.7 OUTLIER -64.89 165.56 10.55 Favored 'General case' 0 C--N 1.278 -2.535 0 CA-C-O 123.884 1.802 . . . . 50.69 115.052 -178.825 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . 0.352 . . -46.29 -37.63 7.57 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 113.945 -1.48 . . . . 32.82 114.497 173.07 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.553 ' ND2' ' HB2' ' A' ' 88' ' ' SER . 0.1 OUTLIER -82.91 7.53 15.16 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.05 2.14 . . . . 54.57 113.075 176.119 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.82 8.25 86.17 Favored Glycine 0 C--O 1.254 1.395 0 C-N-CA 117.642 -2.218 . . . . 27.82 113.05 175.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.56 142.38 31.11 Favored 'General case' 0 C--O 1.255 1.382 0 CA-C-O 124.972 2.32 . . . . 30.09 117.192 178.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -120.84 112.98 19.49 Favored 'General case' 0 C--O 1.2 -1.532 0 CA-C-N 113.658 -1.61 . . . . 21.87 111.071 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 16.1 p -137.82 6.92 2.71 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 115.04 1.496 . . . . 31.02 115.04 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.526 ' HB2' ' O ' ' A' ' 594' ' ' HOH . 7.4 t-20 -87.84 116.62 66.74 Favored Pre-proline 0 N--CA 1.498 1.94 0 O-C-N 124.734 1.271 . . . . 34.01 108.946 -178.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -73.64 151.12 46.37 Favored 'Trans proline' 0 C--O 1.265 1.848 0 C-N-CA 121.907 1.738 . . . . 30.68 112.287 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 17.6 m -133.92 153.17 35.81 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.931 0 CA-C-N 114.349 -1.296 . . . . 15.76 112.935 177.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 16.4 tp -109.28 138.51 45.53 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 113.548 0.944 . . . . 17.63 113.548 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -124.79 97.43 38.72 Favored Pre-proline 0 CA--C 1.511 -0.536 0 N-CA-C 104.989 -2.226 . . . . 19.44 104.989 176.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.56 -25.24 55.16 Favored 'Trans proline' 0 N--CA 1.414 -3.158 0 N-CA-C 115.097 1.153 . . . . 29.35 115.097 -171.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 32.0 mtm180 -86.03 -2.07 57.95 Favored 'General case' 0 C--O 1.186 -2.242 0 CA-C-O 114.936 -2.459 . . . . 66.01 115.593 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 76.1 mt -106.15 164.83 11.68 Favored 'General case' 0 CA--C 1.488 -1.406 0 CA-C-N 121.428 1.922 . . . . 29.72 113.108 -173.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' THR . . . . . 0.401 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 4.3 p -124.01 143.54 50.36 Favored 'General case' 0 C--O 1.256 1.404 0 O-C-N 126.618 2.449 . . . . 23.73 108.566 174.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.461 HD21 ' HB3' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -57.25 -43.25 82.79 Favored 'General case' 0 C--N 1.364 1.196 0 CA-C-O 122.546 1.165 . . . . 31.51 110.495 179.484 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -52.85 -45.62 67.46 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 126.81 3.195 . . . . 76.46 116.011 -179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 103' ' ' THR . 13.4 pt-20 -72.71 -12.96 61.23 Favored 'General case' 0 C--N 1.31 -1.119 0 O-C-N 118.605 -2.559 . . . . 24.3 113.638 -177.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 98.2 mt -77.84 -24.04 48.77 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 116.612 2.079 . . . . 24.82 116.612 -172.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -54.75 134.15 47.5 Favored 'General case' 0 C--O 1.257 1.456 0 CA-C-N 112.369 -2.196 . . . . 83.2 112.273 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 82.07 -2.34 84.34 Favored Glycine 0 C--O 1.264 1.993 0 C-N-CA 119.651 -1.262 . . . . 34.77 114.156 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 85.8 m-70 -96.02 -178.87 4.49 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 117.058 -1.857 . . . . 27.97 106.052 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -123.79 139.53 53.88 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 118.068 -0.968 . . . . 26.79 111.957 179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.86 HD13 HD13 ' A' ' 45' ' ' ILE . 2.2 mm -98.52 131.54 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 N-CA-C 107.529 -1.285 . . . . 62.57 107.529 174.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 24.2 tpp -115.44 139.72 49.78 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 116.23 1.937 . . . . 18.08 116.23 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 80.4 mt -115.84 128.17 73.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 104.622 -2.362 . . . . 18.24 104.622 172.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -98.86 168.53 10.06 Favored 'General case' 0 N--CA 1.484 1.244 0 O-C-N 121.414 -0.804 . . . . 20.24 113.064 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -75.15 -44.84 44.55 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 112.927 0.714 . . . . 25.41 112.927 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -76.03 -178.18 43.97 Favored Glycine 0 C--N 1.361 1.952 0 O-C-N 126.881 2.613 . . . . 20.31 111.036 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -89.55 -158.01 33.79 Favored Glycine 0 CA--C 1.54 1.602 0 C-N-CA 124.506 1.05 . . . . 20.26 111.595 177.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 51.9 t0 -144.72 104.8 4.06 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 120.079 -1.836 . . . . 20.47 108.391 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -90.51 2.5 55.68 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 120.142 1.337 . . . . 33.87 113.093 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HIS . . . . . 0.417 ' HD2' ' O ' ' A' ' 70' ' ' GLY . 48.0 m80 58.9 45.13 15.64 Favored 'General case' 0 C--O 1.247 0.924 0 N-CA-C 114.422 1.268 . . . . 26.63 114.422 178.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 22.7 t -159.7 162.5 35.04 Favored 'General case' 0 C--N 1.349 0.549 0 CA-C-N 112.831 -1.986 . . . . 23.19 108.466 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -94.38 -0.07 55.13 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-O 124.48 2.086 . . . . 34.65 106.786 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 5.9 mtm -123.36 144.04 42.83 Favored Pre-proline 0 C--O 1.265 1.91 0 O-C-N 118.312 -2.743 . . . . 31.41 111.773 173.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -84.34 -2.29 57.81 Favored 'Cis proline' 0 C--N 1.361 1.195 0 N-CA-C 116.754 1.79 . . . . 36.26 116.754 1.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.22 138.78 54.11 Favored 'General case' 0 C--O 1.257 1.46 0 N-CA-C 106.491 -1.67 . . . . 79.39 106.491 -179.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.05 160.57 4.74 Favored 'General case' 0 C--N 1.3 -1.552 0 C-N-CA 114.829 -2.748 . . . . 29.45 110.781 -179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.511 HD22 ' CE1' ' A' ' 61' ' ' HIS . 10.8 mt 46.78 35.75 3.36 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 112.575 -2.102 . . . . 25.81 115.279 176.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 75.17 10.03 84.19 Favored Glycine 0 CA--C 1.545 1.956 0 N-CA-C 117.223 1.649 . . . . 25.16 117.223 178.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 75.38 20.11 78.99 Favored Glycine 0 CA--C 1.572 3.625 0 O-C-N 120.515 -1.58 . . . . 22.38 114.202 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -66.75 -33.82 85.44 Favored Glycine 0 CA--C 1.557 2.665 0 CA-C-N 120.516 2.158 . . . . 20.04 114.47 177.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' GLY . . . . . . . . . . . . . . . 65.23 -134.18 36.48 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-N 114.858 -0.671 . . . . 20.82 112.781 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.28 157.51 6.3 Favored 'General case' 0 C--N 1.364 1.21 0 C-N-CA 123.252 0.621 . . . . 23.71 112.474 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -96.72 133.36 41.37 Favored 'General case' 0 C--O 1.251 1.133 0 N-CA-C 106.708 -1.59 . . . . 25.29 106.708 175.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 31.7 m -117.23 -26.4 2.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 C-N-CA 115.153 -2.619 . . . . 32.24 114.375 -177.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . 0.342 . . -139.08 140.45 38.02 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 119.081 -1.048 . . . . 20.11 112.631 176.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' CYS . . . . . . . . . . . . . 48.7 t -141.8 152.38 43.66 Favored 'General case' 0 C--O 1.263 1.777 0 N-CA-C 116.177 1.917 . . . . 26.2 116.177 -175.288 -174.293 -84.686 -74.972 104.818 2.028 104.429 -66.454 -70.213 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -162.45 141.91 7.55 Favored Glycine 0 C--N 1.355 1.618 0 N-CA-C 106.471 -2.652 . . . . 27.78 106.471 178.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 70.1 t -90.34 127.42 42.88 Favored 'Isoleucine or valine' 0 C--O 1.246 0.92 0 C-N-CA 130.532 3.533 . . . . 28.86 112.061 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 3.5 mp -85.22 110.83 19.87 Favored 'Isoleucine or valine' 0 C--O 1.251 1.141 0 CA-C-O 122.702 1.239 . . . . 30.61 109.795 -176.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.504 -0.794 0 CA-C-N 112.52 -2.127 . . . . 78.37 108.946 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' IUM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 559' ' ' IUM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 594' ' ' HOH . . . . . 0.526 ' O ' ' HB2' ' A' ' 95' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_