data_2muu_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 2muu _Structure_validation_residue.Date_analyzed 2016-10-08 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 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.415 HE21 ' HB3' ' A' ' 27' ' ' GLN . 1.7 mm100 . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.436 ' CD2' HD23 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -45.62 -51.62 11.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.065 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 29' ' ' ARG . 1.7 mtp180 -64.06 -22.23 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.617 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 27' ' ' GLN . 45.0 mt-10 -85.46 -20.2 30.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.847 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 mt -93.83 -50.84 11.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.575 0.702 . . . . 0.0 111.396 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.692 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 1.6 p -92.69 -38.0 12.08 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.143 -177.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.692 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 77.42 35.97 35.58 Favored Glycine 0 CA--C 1.522 0.5 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.575 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -90.81 150.5 3.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.054 0.454 . . . . 0.0 111.057 -179.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.38 23.74 12.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.988 -179.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.575 ' H ' HG22 ' A' ' 34' ' ' ILE . 40.1 t0 -120.64 74.37 24.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.156 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -36.07 -25.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.929 2.419 . . . . 0.0 112.177 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -73.13 -51.62 17.28 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.09 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.671 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -70.31 -27.44 64.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.488 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -69.45 -55.94 8.84 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.311 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -58.14 -25.17 61.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.386 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -66.29 -49.1 68.23 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HB3' ' CD2' ' A' ' 58' ' ' LEU . . . -58.14 -44.85 88.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.248 179.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.436 HD23 ' CD2' ' A' ' 28' ' ' LEU . 3.7 mm? -63.05 -34.0 76.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.011 0.434 . . . . 0.0 110.097 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 1.4 tmtm? -72.9 -30.8 64.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.033 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.45 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.42 -28.79 28.61 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.245 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.709 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 1.1 m -84.5 3.59 35.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.423 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m120 68.54 21.31 8.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.166 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.66 0.35 49.43 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.479 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.28 130.57 34.55 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.139 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.495 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -78.01 -52.2 16.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.512 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.495 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 28.5 m -52.26 -53.2 46.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 111.268 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.467 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 mm-40 -59.39 -56.77 17.84 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.427 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.709 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -41.69 -57.31 2.34 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-O 122.193 0.997 . . . . 0.0 108.593 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.483 ' O ' ' CG2' ' A' ' 59' ' ' THR . 2.1 t -43.02 -57.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.454 -1.703 . . . . 0.0 108.324 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.7 t -46.73 -52.94 12.85 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.164 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 13.7 mt -50.18 -38.97 42.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.219 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.471 HD23 ' CE2' ' A' ' 39' ' ' PHE . 21.0 mt -81.03 -53.81 6.1 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.123 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.483 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.683 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.234 0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 110.879 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.693 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 4.1 pp -82.11 -30.31 31.27 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.478 ' N ' HD11 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.6 0.714 . . . . 0.0 109.881 -178.809 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -80.94 -48.48 12.24 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.232 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.78 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.693 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -65.63 -42.72 93.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.838 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.12 -48.2 68.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.966 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -38.56 83.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.66 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -20.7 25.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 111.461 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.557 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 23.1 tp . . . . . 0 C--N 1.32 -0.698 0 CA-C-O 121.537 0.684 . . . . 0.0 109.459 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.101 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.446 HD22 ' CD2' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -53.26 -51.65 61.57 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.302 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -23.01 63.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.631 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.29 -44.12 16.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.433 HD13 HG22 ' A' ' 31' ' ' ILE . 63.1 mt -69.81 -54.78 17.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.416 0.627 . . . . 0.0 111.438 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.511 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 4.7 p -76.13 -36.59 58.75 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.553 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.509 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 72.2 36.15 60.24 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.533 HD12 ' CZ ' ' A' ' 39' ' ' PHE . 1.7 mm -90.62 151.29 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.173 0.511 . . . . 0.0 111.703 -178.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -119.33 23.26 11.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.707 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.631 ' O ' ' N ' ' A' ' 38' ' ' SER . 46.5 t0 -120.37 69.92 15.85 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.212 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -36.94 -21.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.753 2.302 . . . . 0.0 111.707 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -75.41 -52.74 10.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.356 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.677 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -69.22 -26.23 64.71 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.506 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 14.1 mt -66.33 -55.93 13.6 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -50.85 -37.18 41.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.598 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -58.22 -45.37 87.81 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.433 ' CB ' HD13 ' A' ' 58' ' ' LEU . . . -58.26 -54.11 50.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.027 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.552 HD23 ' H ' ' A' ' 44' ' ' LEU . 3.8 mm? -62.64 -20.22 64.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.278 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -79.01 -54.13 6.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.973 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.26 -29.48 69.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.489 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 4.0 p -76.15 -16.75 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m120 68.24 33.37 4.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.498 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.48 -20.97 42.63 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.489 ' O ' ' OG ' ' A' ' 47' ' ' SER . 36.0 m-20 -68.53 118.46 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.5 HG21 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -74.18 -53.17 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.52 -179.726 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.5 ' N ' HG21 ' A' ' 51' ' ' ILE . 39.3 m -45.76 -55.52 6.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.344 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.35 -57.35 11.6 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.674 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.409 ' O ' HD11 ' A' ' 58' ' ' LEU . . . -41.86 -47.65 4.26 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 109.785 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.485 ' O ' ' CG2' ' A' ' 59' ' ' THR . 24.6 t -53.95 -59.75 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.817 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -54.59 -44.82 73.37 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.806 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.3 mt -58.09 -36.23 72.56 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.485 0.66 . . . . 0.0 110.893 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.593 ' HG ' ' CE2' ' A' ' 39' ' ' PHE . 7.2 mp -84.35 -40.23 18.14 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.787 -1.097 . . . . 0.0 113.268 -177.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.485 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 1.5 t . . . . . 0 C--N 1.318 -0.802 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.84 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.237 0.403 0 CA-C-O 120.635 0.255 . . . . 0.0 111.091 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.783 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.95 -19.71 36.65 Favored 'General case' 0 C--O 1.216 -0.666 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.442 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.506 ' N ' HD23 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -67.77 -36.69 80.95 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.504 -0.879 . . . . 0.0 108.769 179.041 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.34 -52.36 8.21 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.516 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.57 -45.5 85.11 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.679 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.1 mm -62.73 -45.8 97.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.988 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.06 91.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.247 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.26 -40.53 94.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.843 0.354 . . . . 0.0 110.346 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -18.02 32.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.902 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.559 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.2 tm? . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.62 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.863 0.364 . . . . 0.0 110.489 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.429 ' CD1' ' HG ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -45.49 -55.78 5.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.803 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -67.31 -20.94 65.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.61 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -80.75 -24.14 38.9 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.449 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.2 mt -95.8 -54.83 6.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.571 0.7 . . . . 0.0 111.062 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.688 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 5.8 p -78.88 -37.92 38.94 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.78 -178.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.688 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 78.79 36.04 30.02 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.549 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -98.74 144.78 11.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.789 0.328 . . . . 0.0 110.964 -179.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.545 ' OE1' ' N ' ' A' ' 35' ' ' GLN . 3.3 mp0 -113.35 22.7 13.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 38' ' ' SER . 1.5 m-20 -111.46 71.6 0.89 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.354 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' CG ' ' A' ' 41' ' ' HIS . 78.2 Cg_exo -35.31 -22.71 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.752 2.301 . . . . 0.0 111.92 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.638 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -74.06 -49.59 23.41 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.869 179.881 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.658 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -73.92 -29.83 62.25 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.48 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.7 mp -69.96 -49.81 48.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.462 -0.79 . . . . 0.0 108.87 177.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.442 ' CG ' ' O ' ' A' ' 37' ' ' PRO . 18.5 m170 -67.06 -24.02 65.93 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.464 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -68.17 -39.02 82.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HB1' ' CB ' ' A' ' 54' ' ' ALA . . . -63.87 -50.12 70.06 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.963 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.429 ' HG ' ' CD1' ' A' ' 28' ' ' LEU . 81.7 mt -65.4 -24.38 67.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.942 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.8 -31.2 45.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.174 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.9 -35.6 26.01 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.928 0.394 . . . . 0.0 110.076 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.57 ' O ' ' OD1' ' A' ' 48' ' ' ASN . 72.3 p -84.28 12.55 6.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.705 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 47' ' ' SER . 24.0 p30 47.4 37.98 6.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.778 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.36 -24.0 32.42 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.244 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.09 104.46 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 117.267 0.534 . . . . 0.0 109.981 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.645 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.3 OUTLIER -60.77 -55.58 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.183 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.645 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.9 m -40.88 -57.55 1.93 Allowed 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.322 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 54' ' ' ALA . 8.6 mt-30 -51.18 -55.01 20.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.696 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.419 ' CB ' HD23 ' A' ' 44' ' ' LEU . . . -41.75 -44.63 3.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.46 0.648 . . . . 0.0 109.704 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.484 ' O ' ' CG2' ' A' ' 59' ' ' THR . 13.7 t -59.22 -59.6 3.61 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.75 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.3 t -52.95 -38.15 61.77 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.593 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.7 mt -67.34 -40.56 85.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.264 0.554 . . . . 0.0 111.285 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.584 ' CD2' ' CZ ' ' A' ' 39' ' ' PHE . 6.9 mp -80.37 -38.98 29.37 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.682 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.484 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 1.3 t . . . . . 0 C--N 1.317 -0.841 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.756 -178.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.285 0 CA-C-O 120.458 0.17 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.704 ' CD2' ' N ' ' A' ' 103' ' ' GLN . 0.5 OUTLIER -83.23 -28.83 28.94 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.486 179.458 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.704 ' N ' ' CD2' ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.26 -39.03 93.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.912 0.863 . . . . 0.0 109.364 -179.204 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -80.31 -54.64 5.54 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.141 -1.39 . . . . 0.0 111.169 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.41 -44.34 76.13 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.351 0.596 . . . . 0.0 109.471 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.668 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -67.37 -41.86 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.364 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.51 89.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -38.97 89.6 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.178 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.65 -18.04 34.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.098 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.566 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.791 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 110.621 -0.14 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.492 HD23 ' N ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -52.6 -55.08 24.86 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.594 -179.386 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.426 ' CD ' ' C ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -63.54 -21.63 66.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.352 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -87.64 -20.32 26.5 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.462 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.0 mt -97.43 -53.53 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-O 121.529 0.68 . . . . 0.0 111.085 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.69 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 3.1 p -77.85 -36.65 49.69 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.95 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.69 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 74.2 35.78 52.33 Favored Glycine 0 CA--C 1.519 0.288 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.533 HG23 ' CE1' ' A' ' 39' ' ' PHE . 1.8 mm -92.72 155.64 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.118 0.485 . . . . 0.0 111.68 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.482 ' H ' HG21 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -118.9 23.2 11.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.41 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.575 ' O ' ' N ' ' A' ' 38' ' ' SER . 4.5 m-20 -125.27 75.94 68.3 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.979 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -39.26 -20.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.597 2.198 . . . . 0.0 111.563 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.575 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -73.67 -53.89 9.37 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.676 -179.407 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.641 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -70.94 -25.6 62.81 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.569 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 9.6 mt -64.74 -54.68 27.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.457 ' CD2' ' O ' ' A' ' 41' ' ' HIS . 5.6 t-160 -57.81 -30.59 65.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.088 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.18 -44.35 95.63 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.422 ' CB ' ' CD1' ' A' ' 58' ' ' LEU . . . -65.82 -42.36 90.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.259 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.5 -31.97 72.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.146 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.424 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.31 -29.39 34.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.183 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.479 ' C ' ' H ' ' A' ' 48' ' ' ASN . . . -77.45 -42.48 35.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.393 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.777 ' HG ' ' CB ' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -72.41 14.13 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.653 0.263 . . . . 0.0 111.007 -179.39 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.666 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.7 OUTLIER 60.42 26.32 15.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.473 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.27 -23.38 34.54 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.48 127.52 31.9 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.595 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.4 OUTLIER -77.56 -57.63 5.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.125 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.595 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 14.4 m -47.84 -45.98 30.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.065 0.46 . . . . 0.0 110.506 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.478 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 41.8 mt-30 -61.71 -55.8 26.46 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.777 ' CB ' ' HG ' ' A' ' 47' ' ' SER . . . -41.47 -58.29 1.94 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.139 0.971 . . . . 0.0 108.511 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.495 ' O ' ' CG2' ' A' ' 59' ' ' THR . 18.1 t -43.56 -54.38 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.754 178.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.5 t -52.43 -44.95 65.74 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.612 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 16.9 mt -57.45 -34.59 69.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.26 0.552 . . . . 0.0 110.888 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.47 ' CD2' ' CE2' ' A' ' 39' ' ' PHE . 13.8 mt -87.84 -26.89 22.57 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -177.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.495 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.677 0 C-N-CA 120.094 -0.643 . . . . 0.0 111.26 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.0 t70 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.504 0.193 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.686 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 0.4 OUTLIER -83.42 -29.04 28.43 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 120.244 -0.582 . . . . 0.0 110.705 179.786 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.685 ' N ' ' CD2' ' A' ' 102' ' ' LEU . 0.1 OUTLIER -64.4 -40.72 96.34 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.529 -0.869 . . . . 0.0 109.341 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -55.59 4.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.919 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.88 -46.61 71.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.159 0.504 . . . . 0.0 109.669 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.686 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.3 mm -62.58 -47.93 90.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.996 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.29 98.58 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.223 -178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -41.02 98.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -18.37 36.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.091 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.562 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.2 tm? . . . . . 0 C--N 1.32 -0.683 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.528 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' N ' ' A' ' 30' ' ' GLU . 2.6 mm-40 . . . . . 0 CA--C 1.522 -0.119 0 CA-C-O 121.038 0.447 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 44' ' ' LEU . 12.4 tp -44.68 -54.27 6.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.97 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -63.03 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.374 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 27' ' ' GLN . 29.6 tt0 -79.29 -21.21 46.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.998 0.428 . . . . 0.0 110.398 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.446 HG21 HD13 ' A' ' 31' ' ' ILE . 59.4 mt -93.96 -44.29 13.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.383 0.611 . . . . 0.0 111.215 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.564 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 3.1 p -91.44 -37.45 13.18 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.312 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.564 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 86.99 34.77 10.48 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.533 ' CG1' ' OG1' ' A' ' 32' ' ' THR . 1.1 mm -100.09 142.27 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.773 0.321 . . . . 0.0 110.39 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -113.85 23.29 13.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.792 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.635 ' O ' ' N ' ' A' ' 38' ' ' SER . 36.4 t0 -112.52 72.51 1.31 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -34.96 -22.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.691 0 C-N-CA 122.877 2.385 . . . . 0.0 112.336 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.635 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.8 OUTLIER -73.68 -52.66 12.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.938 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.685 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -72.26 -26.01 61.83 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.457 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mp -71.91 -53.17 13.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -60.72 -24.92 66.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.128 178.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -65.79 -46.11 79.93 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.418 ' HB3' ' CD2' ' A' ' 58' ' ' LEU . . . -61.53 -51.52 68.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.071 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 28' ' ' LEU . 4.3 mm? -55.04 -36.27 65.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.207 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 4.4 tmtt? -76.54 -28.74 56.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.446 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.462 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.32 -20.88 33.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.914 0.388 . . . . 0.0 110.735 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 48' ' ' ASN . 42.2 t -93.02 -6.83 47.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.381 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.677 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.2 OUTLIER 74.75 26.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.055 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.12 -21.59 41.07 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.35 123.64 20.93 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.639 ' CG2' ' N ' ' A' ' 52' ' ' THR . 2.2 tt -75.56 -56.03 9.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.036 -179.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.639 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.2 m -46.09 -52.34 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.809 0.337 . . . . 0.0 110.662 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.5 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 28.1 mt-30 -59.64 -53.68 55.23 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.37 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.0 -53.52 2.95 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.457 ' O ' ' CG2' ' A' ' 59' ' ' THR . 39.5 t -47.73 -58.73 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.949 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.2 t -46.02 -48.53 16.74 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.249 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.5 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.6 mp -62.53 -27.64 69.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.199 0.523 . . . . 0.0 111.02 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.547 ' CD2' ' CZ ' ' A' ' 39' ' ' PHE . 52.6 mt -90.31 -14.02 34.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.853 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.457 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.568 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.329 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 C--O 1.236 0.345 0 CA-C-O 120.604 0.24 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.762 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -81.39 -22.52 38.24 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.73 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.505 ' N ' HD23 ' A' ' 102' ' ' LEU . 6.4 mt-30 -66.71 -40.84 88.61 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.677 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.95 -53.22 9.37 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.362 -1.29 . . . . 0.0 111.026 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.68 -51.52 68.43 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.663 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -55.38 -45.01 77.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.938 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.89 -31.04 69.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.136 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -28.0 63.27 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.013 0.435 . . . . 0.0 109.854 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.7 -18.66 16.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 106' ' ' ILE . 4.7 tt . . . . . 0 C--N 1.32 -0.679 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.571 -178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.146 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.422 ' CD2' HD23 ' A' ' 40' ' ' LEU . 11.1 tp -46.45 -51.86 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.554 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -60.91 -21.29 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.437 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.467 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.3 tt0 -86.43 -24.25 25.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.3 mt -87.26 -53.35 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 CA-C-O 121.889 0.852 . . . . 0.0 110.537 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.496 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.7 p -82.63 -37.29 25.16 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.048 -1.433 . . . . 0.0 111.675 -178.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.28 35.34 17.96 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.551 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -99.41 142.42 15.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.893 0.378 . . . . 0.0 110.827 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -112.96 23.35 13.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.46 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.611 ' O ' ' N ' ' A' ' 38' ' ' SER . 15.2 m-20 -112.39 73.94 1.46 Allowed Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.441 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -35.36 -24.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.605 2.203 . . . . 0.0 112.021 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.611 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -71.88 -52.98 14.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.258 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.687 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -70.99 -25.21 62.6 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.766 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.478 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -71.84 -47.84 50.27 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.771 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -65.26 -26.96 68.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.123 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.51 -53.77 42.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.432 ' CB ' ' CD1' ' A' ' 58' ' ' LEU . . . -59.69 -38.37 81.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.261 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.487 ' N ' HD21 ' A' ' 44' ' ' LEU . 3.3 mm? -67.36 -30.12 69.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.934 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -77.26 -33.94 55.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.11 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.474 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -81.86 -37.9 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.749 -179.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 48' ' ' ASN . 32.0 p -67.53 -12.75 61.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.757 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.411 ' CB ' ' O ' ' A' ' 47' ' ' SER . 0.2 OUTLIER 74.03 37.79 0.61 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.83 -23.58 30.25 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -67.71 125.61 26.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.833 0.349 . . . . 0.0 110.281 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.633 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.6 OUTLIER -78.02 -57.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -179.636 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.633 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 18.5 m -45.39 -53.04 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.937 0.399 . . . . 0.0 110.568 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.492 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 44.9 mt-30 -55.69 -55.33 33.47 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.283 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -41.33 -54.04 3.12 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.586 0.708 . . . . 0.0 109.149 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.456 ' HB ' ' O ' ' A' ' 52' ' ' THR . 61.6 t -47.57 -56.96 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.635 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -51.28 -46.67 62.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.306 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.492 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.1 mp -60.2 -34.54 73.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 0.0 111.327 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.503 ' CD2' ' CE2' ' A' ' 39' ' ' PHE . 18.8 mt -81.44 -58.18 3.14 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.428 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.455 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.773 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.672 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.0 t70 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.677 0.275 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.667 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 4.5 pp -76.25 -32.03 58.66 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.364 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.554 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 0.9 OUTLIER -63.41 -38.49 91.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.724 0.774 . . . . 0.0 109.508 -179.028 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.51 -56.41 4.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.595 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.64 -55.02 29.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.667 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.6 mm -51.89 -52.96 19.72 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.754 179.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.86 73.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.057 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.445 ' C ' ' CD2' ' A' ' 108' ' ' LEU . 8.6 tt -58.18 -32.52 68.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.884 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.06 -18.14 22.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.984 0.421 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.638 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 1.1 tp . . . . . 0 C--N 1.319 -0.751 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.71 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.756 0.312 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.446 ' H ' HD13 ' A' ' 51' ' ' ILE . 6.6 tp -52.88 -57.93 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.908 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -59.4 -21.52 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.29 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.2 -35.01 25.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.826 0.346 . . . . 0.0 110.769 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.6 mt -73.0 -52.41 22.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-O 121.659 0.743 . . . . 0.0 110.684 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.477 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.0 p -79.74 -35.32 39.02 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.609 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 67.28 36.15 89.11 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.568 HG23 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -89.32 155.71 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.256 -0.472 . . . . 0.0 111.705 -178.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -122.26 23.35 9.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.608 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.669 ' O ' ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -119.77 70.09 13.41 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -34.83 -20.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.962 2.441 . . . . 0.0 112.221 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.669 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -73.73 -52.43 13.23 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.632 179.66 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.699 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -69.33 -25.38 64.18 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.514 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mt -69.61 -59.79 2.74 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.723 ' ND1' ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -57.51 -27.57 62.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.447 179.136 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.723 ' N ' ' ND1' ' A' ' 41' ' ' HIS . 62.9 tt0 -61.3 -56.77 16.74 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.67 179.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.435 ' HB2' ' CD2' ' A' ' 58' ' ' LEU . . . -58.56 -38.7 78.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.503 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.0 mm? -67.59 -24.9 65.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.96 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.43 -30.59 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.179 179.237 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.431 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -82.07 -36.95 27.12 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.813 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.666 ' HG ' ' CB ' ' A' ' 50' ' ' ASP . 41.4 t -72.58 -16.24 61.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 73.6 36.38 0.78 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.956 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.66 -23.69 35.13 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.666 ' CB ' ' HG ' ' A' ' 47' ' ' SER . 0.4 OUTLIER -66.97 116.08 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.6 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.7 tt -70.15 -50.88 43.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.408 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.6 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 54.4 m -50.87 -61.44 2.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.289 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.474 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 0.7 OUTLIER -49.85 -56.24 11.19 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.887 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.05 -55.18 2.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.459 ' O ' ' CG2' ' A' ' 59' ' ' THR . 21.4 t -47.24 -58.57 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.746 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.6 t -48.47 -50.08 32.97 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.474 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 5.0 mp -55.4 -36.78 66.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.196 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.505 HD23 ' CE2' ' A' ' 39' ' ' PHE . 25.5 mt -80.5 -62.21 1.74 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.941 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.459 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.314 -0.956 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.542 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.675 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -77.18 -34.76 56.25 Favored 'General case' 0 C--O 1.21 -0.976 0 C-N-CA 120.304 -0.559 . . . . 0.0 112.425 -178.441 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.556 ' N ' ' CD2' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -63.22 -35.66 81.08 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.806 0.812 . . . . 0.0 109.561 -178.766 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.68 -56.57 4.2 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.442 -1.253 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.62 -47.7 73.12 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.518 0.675 . . . . 0.0 109.289 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.675 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.8 mm -61.08 -46.72 96.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.612 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.771 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.39 -45.7 92.62 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.85 -179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.3 tp -59.62 -43.33 93.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.647 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.0 -19.17 34.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.245 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.517 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 . . . . . 0 CA--C 1.527 0.082 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -51.33 -48.72 62.33 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 119.807 -0.757 . . . . 0.0 110.479 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.75 -22.35 65.23 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.141 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -85.86 -20.86 28.48 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.981 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.414 HD11 HG22 ' A' ' 31' ' ' ILE . 94.1 mt -94.49 -38.8 9.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-O 121.6 0.714 . . . . 0.0 110.927 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.454 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 11.4 p -94.89 -35.39 12.05 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.794 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.74 36.0 58.39 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.565 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -93.72 152.22 3.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.246 -0.477 . . . . 0.0 111.237 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -120.73 23.59 10.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.035 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.628 ' O ' ' N ' ' A' ' 38' ' ' SER . 10.2 t70 -120.16 74.24 21.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.5 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -37.28 -20.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.666 2.244 . . . . 0.0 111.683 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.633 ' O ' ' ND1' ' A' ' 41' ' ' HIS . 0.7 OUTLIER -69.95 -54.0 15.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.549 -179.449 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.666 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -74.42 -26.39 60.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 10.6 mt -63.08 -46.88 85.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.633 ' ND1' ' O ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -67.57 -36.42 80.89 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.796 179.174 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.571 ' N ' ' CD2' ' A' ' 41' ' ' HIS . 4.9 tt0 -51.89 -49.12 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.551 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HB2' ' CD2' ' A' ' 58' ' ' LEU . . . -69.29 -56.83 6.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.564 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.552 ' N ' HD21 ' A' ' 44' ' ' LEU . 4.1 mm? -45.33 -25.79 0.44 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.407 ' N ' ' C ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -83.78 -49.38 9.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.347 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 48' ' ' ASN . . . -64.12 -41.98 97.02 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.75 0.309 . . . . 0.0 110.968 -179.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.496 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 6.8 p -68.09 4.65 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.809 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.464 ' H ' ' C ' ' A' ' 46' ' ' ALA . 3.2 m-80 56.48 33.22 22.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.7 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.79 -23.6 35.27 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.496 ' O ' ' OG ' ' A' ' 47' ' ' SER . 11.7 m-20 -62.45 106.13 0.72 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.556 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -63.78 -58.4 7.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.691 -179.379 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.556 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.1 m -43.89 -46.19 7.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.122 0.487 . . . . 0.0 110.336 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.635 ' OE1' ' N ' ' A' ' 53' ' ' GLN . 1.8 mp0 -64.74 -53.54 45.53 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -42.02 -54.02 3.68 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.468 ' O ' ' CG2' ' A' ' 59' ' ' THR . 69.1 t -46.72 -58.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.126 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -48.86 -46.98 43.13 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.98 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.476 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 5.9 mp -62.27 -34.3 76.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.132 0.491 . . . . 0.0 111.413 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.473 HD23 ' CE2' ' A' ' 39' ' ' PHE . 18.9 mt -87.89 -14.1 40.26 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -177.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.468 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 1.4 t . . . . . 0 C--N 1.32 -0.701 0 C-N-CA 119.523 -0.871 . . . . 0.0 112.887 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.279 0 CA-C-O 120.385 0.136 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.754 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.77 -20.56 30.83 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.845 179.027 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.487 ' N ' HD22 ' A' ' 102' ' ' LEU . 3.2 mt-30 -68.34 -35.63 78.05 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -81.06 -49.66 10.61 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.352 -1.295 . . . . 0.0 110.61 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.92 -42.27 97.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.674 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.0 mm -65.07 -50.04 76.45 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.792 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.08 -47.92 84.1 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.9 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.43 -43.69 88.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.771 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -18.94 38.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.175 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 2.4 tt . . . . . 0 C--N 1.32 -0.692 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.424 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' GLU . 12.3 mm-40 . . . . . 0 C--O 1.232 0.182 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.422 HD22 ' CD1' ' A' ' 44' ' ' LEU . 15.9 tp -45.42 -49.84 12.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.407 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 1.1 tmt_? -63.27 -20.57 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.161 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 27' ' ' GLN . 4.8 tp10 -84.39 -22.07 30.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.127 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.7 mt -92.5 -52.98 9.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.727 0.775 . . . . 0.0 110.72 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.424 ' OG1' HG13 ' A' ' 34' ' ' ILE . 9.7 p -81.76 -36.8 28.12 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.378 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 29' ' ' ARG . . . 79.14 35.78 29.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.549 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -98.57 140.66 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.989 0.423 . . . . 0.0 111.201 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -112.06 22.64 14.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.318 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.549 ' H ' HG21 ' A' ' 34' ' ' ILE . 4.4 t70 -110.67 74.44 0.92 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.979 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -35.88 -25.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.723 2.282 . . . . 0.0 112.393 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -68.9 -53.11 22.94 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.683 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -73.17 -24.97 60.62 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.154 0.502 . . . . 0.0 109.652 -179.794 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.493 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -69.67 -51.43 34.74 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.625 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -24.97 63.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.94 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -68.31 -39.16 82.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.47 ' CB ' ' CD1' ' A' ' 58' ' ' LEU . . . -68.93 -55.68 10.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.446 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.455 ' N ' HD12 ' A' ' 44' ' ' LEU . 7.5 mp -53.86 -36.75 62.95 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.25 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -53.99 37.15 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.56 -24.89 50.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.74 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.58 -7.65 49.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 65.88 39.01 4.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.811 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.53 -23.39 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.517 ' C ' ' OD1' ' A' ' 50' ' ' ASP . 16.4 t0 -64.17 93.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.651 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.5 tt -50.59 -57.87 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.143 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.651 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 38.6 m -42.07 -53.46 3.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.98 0.419 . . . . 0.0 110.28 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.505 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 2.2 mt-30 -57.04 -53.89 52.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.209 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -40.38 -57.3 1.81 Allowed 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.425 ' HB ' ' O ' ' A' ' 52' ' ' THR . 40.3 t -46.62 -60.75 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.856 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -42.39 -49.71 5.17 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.741 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.505 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.3 mp -60.43 -36.66 78.7 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.696 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.526 ' CD2' ' CE2' ' A' ' 39' ' ' PHE . 11.5 mt -90.84 -11.01 40.61 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.171 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.415 ' N ' ' O ' ' A' ' 55' ' ' VAL . 82.2 p . . . . . 0 C--N 1.317 -0.812 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.624 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 37.6 t70 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.438 0.161 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.701 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -83.5 -24.83 31.55 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.069 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.538 ' H ' HD12 ' A' ' 102' ' ' LEU . 1.8 mt-30 -68.08 -39.89 82.82 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 118.992 -1.083 . . . . 0.0 109.3 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -51.57 9.03 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.744 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.14 78.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 5.4 mm -61.55 -57.98 9.62 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.788 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -51.85 -44.68 63.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 110.921 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.5 tp -59.3 -40.96 87.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.715 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.04 -17.13 36.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.413 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.65 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.687 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.804 0.335 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.442 HD23 ' CD2' ' A' ' 44' ' ' LEU . 40.8 tp -47.77 -55.99 8.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.696 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -62.1 -25.99 68.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.897 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 29' ' ' ARG . 10.4 mt-10 -76.54 -27.29 55.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.026 0.441 . . . . 0.0 110.375 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.4 mt -85.1 -43.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.787 0.803 . . . . 0.0 110.618 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.531 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 7.7 p -90.6 -34.73 15.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.469 -178.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 81.71 35.36 22.5 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.547 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -94.95 148.47 5.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.895 0.379 . . . . 0.0 111.007 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -117.83 23.25 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.212 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.632 ' O ' ' N ' ' A' ' 38' ' ' SER . 17.2 m-20 -119.45 72.83 14.74 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.637 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -36.37 -20.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.79 2.326 . . . . 0.0 112.036 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -72.51 -53.76 11.15 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.728 -1.123 . . . . 0.0 111.387 -179.245 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.673 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -71.13 -28.41 64.27 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.609 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 8.5 mt -62.35 -51.97 65.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -59.69 -33.98 72.27 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.721 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -56.32 -47.76 78.08 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.406 ' CB ' HD11 ' A' ' 58' ' ' LEU . . . -63.83 -54.24 38.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.732 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.442 ' CD2' HD23 ' A' ' 28' ' ' LEU . 4.3 mm? -46.89 -37.36 8.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.866 0.365 . . . . 0.0 110.325 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -80.79 -28.53 36.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.323 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.449 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -77.31 -21.62 53.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.118 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.504 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 59.7 p -101.02 17.78 21.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.77 0.319 . . . . 0.0 110.987 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.504 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.1 OUTLIER 48.89 32.16 3.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.151 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.08 -24.29 31.69 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.522 ' OD2' ' NE2' ' A' ' 53' ' ' GLN . 25.4 m-20 -65.57 99.7 0.45 Allowed 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.386 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.619 ' CG2' ' N ' ' A' ' 52' ' ' THR . 15.1 tt -57.58 -56.73 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.864 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.619 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 55.4 m -43.55 -60.13 1.88 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.021 0.438 . . . . 0.0 110.071 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.522 ' NE2' ' OD2' ' A' ' 50' ' ' ASP . 27.2 mt-30 -50.13 -57.98 6.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.635 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -38.48 -58.39 1.03 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.476 ' O ' ' CG2' ' A' ' 59' ' ' THR . 11.0 t -42.69 -57.46 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.091 0 CA-C-N 115.29 -0.868 . . . . 0.0 108.722 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.456 ' N ' ' O ' ' A' ' 53' ' ' GLN . 6.8 t -48.47 -47.32 38.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.359 -1.291 . . . . 0.0 110.919 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.472 HD11 ' O ' ' A' ' 53' ' ' GLN . 4.2 mp -59.65 -36.34 76.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.092 0.472 . . . . 0.0 110.988 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 54' ' ' ALA . 27.5 mt -81.18 -22.65 38.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.797 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.476 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.644 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.19 -178.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.172 0 CA-C-O 120.789 0.328 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.652 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 4.6 pp -79.47 -34.65 41.28 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.212 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.548 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -62.57 -40.37 96.64 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.813 0.816 . . . . 0.0 109.392 -179.073 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.2 -56.55 4.27 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.889 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.21 -44.67 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.17 0.509 . . . . 0.0 109.834 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.652 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.9 mm -64.63 -53.15 45.83 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.388 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.91 -50.15 73.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.94 0.4 . . . . 0.0 110.605 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -46.3 78.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.852 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.54 -16.93 53.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.54 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.321 -0.668 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.556 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.627 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 3.9 mm-40 . . . . . 0 C--O 1.226 -0.155 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.607 ' CD2' ' H ' ' A' ' 29' ' ' ARG . 1.4 pt? -70.68 -48.6 53.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.519 -178.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.607 ' H ' ' CD2' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.5 -26.6 67.24 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.526 -179.224 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.41 ' N ' ' HG3' ' A' ' 29' ' ' ARG . 29.5 tp10 -87.87 -57.5 2.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.22 0.533 . . . . 0.0 110.47 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.627 ' CG2' ' O ' ' A' ' 27' ' ' GLN . 16.4 tt -54.43 -35.46 31.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.672 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.592 ' OG1' ' O ' ' A' ' 28' ' ' LEU . 46.8 p -92.25 -31.28 15.47 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.722 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 70.25 36.31 70.68 Favored Glycine 0 N--CA 1.462 0.394 0 N-CA-C 109.103 -1.599 . . . . 0.0 109.103 -179.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.609 ' CG2' ' H ' ' A' ' 36' ' ' ASP . 3.8 mm -92.5 152.92 3.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.583 -0.808 . . . . 0.0 112.633 -177.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.452 ' N ' HG22 ' A' ' 34' ' ' ILE . 1.9 mt-30 -122.93 18.75 10.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.483 178.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.666 ' O ' ' N ' ' A' ' 38' ' ' SER . 1.4 m-20 -119.54 65.56 8.92 Favored Pre-proline 0 N--CA 1.455 -0.19 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -35.81 -20.33 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.851 0 C-N-CA 122.973 2.448 . . . . 0.0 111.971 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 36' ' ' ASP . 25.2 t -75.33 -52.68 10.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.787 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -71.1 -24.15 62.24 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.444 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 24.0 mt -66.41 -59.9 3.25 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.337 -1.302 . . . . 0.0 108.917 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.653 ' C ' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -53.89 -40.31 66.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.603 179.51 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -49.88 -48.73 51.23 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' ' CD2' ' A' ' 58' ' ' LEU . . . -61.67 -59.94 4.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.498 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.465 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 2.2 mm? -45.27 -24.24 0.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.887 0.375 . . . . 0.0 110.017 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.478 ' HD3' ' ND1' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -82.64 -42.24 18.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.792 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.6 -24.29 53.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.474 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 84.1 p -84.92 -2.95 58.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.344 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.7 m120 60.73 26.84 16.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.101 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.97 -24.03 31.85 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 121.027 -0.606 . . . . 0.0 111.75 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.16 102.62 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.697 -0.401 . . . . 0.0 109.947 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.647 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.8 OUTLIER -58.77 -57.41 11.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.873 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.647 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 25.8 m -41.2 -61.28 1.04 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.197 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.49 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 31.9 mt-30 -50.58 -55.99 13.78 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.618 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.21 -54.03 3.02 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.446 ' O ' ' CG2' ' A' ' 59' ' ' THR . 23.4 t -45.57 -59.51 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.221 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.1 t -45.38 -49.24 13.24 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.101 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.49 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.5 mp -63.54 -27.62 69.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.811 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.568 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 89.4 mt -91.49 -9.48 44.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.704 -178.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.446 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.323 -0.547 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.41 -179.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.9 t0 . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.724 0.297 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.666 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 3.9 pp -78.85 -32.71 46.16 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.085 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.601 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 2.1 tt0 -65.3 -38.86 91.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.761 0.791 . . . . 0.0 109.733 -178.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.79 -49.92 12.19 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.93 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.435 0.636 . . . . 0.0 109.399 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.666 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -63.46 -43.43 98.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.975 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.83 80.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.186 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.92 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.58 -20.71 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.183 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.573 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.321 -0.664 0 CA-C-O 121.57 0.7 . . . . 0.0 109.143 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 . . . . . 0 C--O 1.234 0.256 0 CA-C-O 121.186 0.517 . . . . 0.0 109.607 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.428 ' CG ' HD23 ' A' ' 44' ' ' LEU . 5.1 mt -44.76 -59.32 2.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.362 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -69.32 -20.49 63.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.095 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.97 -21.36 40.39 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.788 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 30.8 mt -98.5 -50.76 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.387 0.613 . . . . 0.0 111.491 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.537 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 3.0 p -85.6 -37.21 19.8 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.492 -178.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.537 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 76.95 36.11 37.1 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.584 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -97.15 154.8 3.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.973 0.416 . . . . 0.0 111.203 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -121.65 23.5 10.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.044 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 38' ' ' SER . 2.4 t70 -121.98 73.73 36.36 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.366 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_exo -36.99 -21.14 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.954 2.436 . . . . 0.0 112.37 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 36' ' ' ASP . 9.3 m -68.57 -54.27 17.68 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.841 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.622 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -75.5 -26.57 58.25 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.606 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 10.6 mt -61.31 -60.29 3.97 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.465 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -52.6 -50.75 62.43 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.754 179.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 41' ' ' HIS . 25.1 tt0 -40.33 -47.28 2.49 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.48 ' HB3' ' CD1' ' A' ' 58' ' ' LEU . . . -60.4 -49.63 76.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.066 178.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.509 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -58.01 -25.22 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.437 179.671 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 41' ' ' HIS . 11.3 mmmt -79.07 -38.98 35.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.94 0.4 . . . . 0.0 110.433 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.6 -26.62 41.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.106 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.487 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 1.9 p -88.32 10.36 20.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.262 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.0 OUTLIER 49.88 30.78 4.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.723 0.297 . . . . 0.0 110.888 179.624 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.51 -23.42 35.15 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.445 ' O ' ' OG ' ' A' ' 47' ' ' SER . 29.6 t0 -63.03 96.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.029 0.442 . . . . 0.0 110.172 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.62 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.0 OUTLIER -56.35 -52.73 48.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.572 -178.973 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.62 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.4 m -50.82 -46.11 59.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.052 0.453 . . . . 0.0 110.929 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.5 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -65.86 -53.56 38.2 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.653 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.428 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.45 -54.56 3.07 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 52' ' ' THR . 42.6 t -46.62 -57.17 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.757 177.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -49.39 -45.97 46.73 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.993 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.5 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.9 mp -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.506 HD21 ' CE2' ' A' ' 39' ' ' PHE . 79.8 mt -86.16 -23.95 26.36 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.899 -178.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.438 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.312 -1.048 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.104 -178.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.1 t70 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.792 0.33 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.661 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 3.6 pp -76.74 -31.12 56.91 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.61 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.591 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -64.1 -39.72 94.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.783 0.801 . . . . 0.0 109.486 -178.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.55 -56.39 4.75 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.209 -1.36 . . . . 0.0 110.438 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.47 39.14 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.661 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -50.46 -65.84 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.317 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.02 15.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.55 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.23 -28.68 69.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.666 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.424 ' N ' ' O ' ' A' ' 106' ' ' ILE . 0.6 OUTLIER -99.59 -16.65 18.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.043 -179.025 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.516 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.32 -0.705 0 CA-C-O 121.552 0.691 . . . . 0.0 109.659 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.415 ' O ' ' N ' ' A' ' 30' ' ' GLU . 24.3 mm-40 . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.98 0.419 . . . . 0.0 109.996 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.423 HD23 ' CD2' ' A' ' 44' ' ' LEU . 10.3 tp -46.6 -51.66 15.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.8 179.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttt180 -63.78 -21.4 66.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.8 tt0 -84.63 -21.91 30.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.579 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 44.3 mt -94.35 -50.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.493 0.663 . . . . 0.0 111.311 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.517 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.5 p -85.52 -37.83 19.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.397 -178.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.36 36.32 17.67 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.522 HG23 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -97.57 143.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.736 0.303 . . . . 0.0 110.351 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -114.89 23.38 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.863 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.586 ' O ' ' N ' ' A' ' 38' ' ' SER . 0.4 OUTLIER -113.83 73.19 2.21 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.338 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -35.11 -24.21 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.938 2.425 . . . . 0.0 112.503 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.2 OUTLIER -71.4 -52.31 19.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.797 179.783 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.678 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -71.19 -28.38 64.18 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.916 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.48 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mp -70.3 -48.35 57.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -62.18 -27.25 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.228 178.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -65.19 -48.38 73.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.504 ' CB ' ' CD1' ' A' ' 58' ' ' LEU . . . -62.2 -47.46 84.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.465 ' N ' HD21 ' A' ' 44' ' ' LEU . 4.1 mm? -55.64 -42.58 75.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.189 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.458 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 5.0 tmtt? -74.44 -27.19 60.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.763 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.458 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -79.2 -24.15 43.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.084 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.787 ' HG ' ' N ' ' A' ' 54' ' ' ALA . 0.4 OUTLIER -96.2 17.01 16.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.162 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 61.95 22.13 12.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.195 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.78 -23.53 33.55 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -62.96 124.03 20.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.632 ' CG2' ' N ' ' A' ' 52' ' ' THR . 4.1 tt -74.72 -55.49 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.077 -179.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.632 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.0 m -43.46 -54.19 4.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 0.0 110.169 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.624 ' CB ' ' HG ' ' A' ' 47' ' ' SER . 25.6 mt-30 -57.73 -54.52 45.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.787 ' N ' ' HG ' ' A' ' 47' ' ' SER . . . -40.37 -51.18 2.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 58' ' ' LEU . 18.1 t -50.38 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.024 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.0 t -41.94 -48.31 4.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.286 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.495 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.6 mp -63.09 -29.82 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.934 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.572 ' CD2' ' CZ ' ' A' ' 39' ' ' PHE . 37.7 mt -89.93 -11.19 42.46 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -177.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.484 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.324 -0.536 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.832 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.239 0.543 0 CA-C-O 120.753 0.311 . . . . 0.0 111.785 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.772 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.19 -17.24 46.88 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.717 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.528 ' N ' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -71.46 -37.16 71.38 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.84 -49.49 20.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.159 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.46 76.45 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.713 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.5 mm -53.96 -48.17 63.86 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.986 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.12 -34.49 73.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.049 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 tp -69.64 -22.7 63.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.11 -18.93 13.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 28.5 tp . . . . . 0 C--N 1.319 -0.736 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.206 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.679 ' OE1' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.786 0.327 . . . . 0.0 110.494 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.463 HD12 ' CD1' ' A' ' 44' ' ' LEU . 1.1 mt -51.84 -51.65 55.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.013 0.435 . . . . 0.0 111.072 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -22.56 46.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.552 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.35 -32.07 22.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.463 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.8 mt -78.9 -55.86 8.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.536 0.684 . . . . 0.0 110.943 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.529 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -78.09 -37.32 46.7 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.762 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.9 36.75 12.68 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -179.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.541 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -98.1 149.43 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.957 0.408 . . . . 0.0 110.851 -179.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -119.56 23.37 11.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.155 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.671 ' O ' ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -120.03 69.04 13.47 Favored Pre-proline 0 N--CA 1.453 -0.325 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.982 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -35.51 -20.45 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.864 2.376 . . . . 0.0 112.044 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.671 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.1 OUTLIER -74.76 -53.26 9.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.438 -179.328 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.69 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -69.78 -24.39 63.5 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.72 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.511 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 2.2 mt -67.47 -59.42 3.39 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.749 ' CE1' ' NZ ' ' A' ' 45' ' ' LYS . 1.2 t-80 -53.91 -26.39 24.87 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.814 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -64.95 -47.55 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.39 82.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.66 178.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 44' ' ' LEU . 4.6 mm? -56.14 -36.86 68.73 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.749 ' NZ ' ' CE1' ' A' ' 41' ' ' HIS . 25.9 mttp -68.93 -46.66 67.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.734 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.6 -22.12 64.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.918 0.39 . . . . 0.0 110.708 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.523 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 62.4 p -90.57 17.6 7.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.489 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.531 ' ND2' ' OD2' ' A' ' 50' ' ' ASP . 0.6 OUTLIER 48.57 30.27 2.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.0 -23.5 35.44 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.531 ' OD2' ' ND2' ' A' ' 48' ' ' ASN . 89.9 m-20 -58.26 115.44 2.95 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.138 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.6 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.2 OUTLIER -69.27 -58.36 5.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.898 -179.255 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.6 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.5 m -45.51 -57.15 4.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.012 0.434 . . . . 0.0 110.575 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.523 ' O ' HD13 ' A' ' 57' ' ' LEU . 8.9 mm100 -51.51 -59.09 4.64 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.609 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.407 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -39.03 -54.76 1.66 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.478 0.656 . . . . 0.0 109.338 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.472 ' O ' ' CG2' ' A' ' 59' ' ' THR . 41.2 t -45.18 -59.19 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.48 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 53' ' ' GLN . 5.0 t -43.93 -49.69 8.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.642 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 53' ' ' GLN . 5.2 mp -60.23 -30.31 69.32 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.249 0.547 . . . . 0.0 110.439 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.558 ' CD2' ' CZ ' ' A' ' 39' ' ' PHE . 41.4 mt -88.07 -14.53 38.66 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.082 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.472 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.545 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.351 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.8 0.333 . . . . 0.0 110.107 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.756 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.21 -23.48 30.47 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.871 179.267 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.514 ' H ' HD11 ' A' ' 102' ' ' LEU . 1.1 mt-30 -67.94 -38.4 82.78 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 118.985 -1.086 . . . . 0.0 108.953 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.74 -51.98 9.03 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.689 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.62 -44.44 85.52 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.425 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -64.47 -43.87 96.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.038 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.27 -53.14 53.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.978 0.418 . . . . 0.0 110.793 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.77 -43.54 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.751 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.61 -19.85 32.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.47 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.584 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 3.7 tt . . . . . 0 C--N 1.321 -0.657 0 CA-C-O 121.103 0.478 . . . . 0.0 109.787 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.1 ptt? . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.582 ' CG2' ' N ' ' A' ' 3' ' ' ALA . 12.6 t -118.04 -138.83 0.36 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.586 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.582 ' N ' ' CG2' ' A' ' 2' ' ' THR . . . -93.17 176.15 6.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.545 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -101.38 154.58 18.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.588 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.707 ' N ' ' CD1' ' A' ' 5' ' ' LEU . 0.0 OUTLIER -134.8 175.16 9.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.561 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.522 ' O ' ' O ' ' A' ' 5' ' ' LEU . 5.4 tp60 39.84 98.68 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.468 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -80.27 -4.98 55.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.661 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.35 -19.43 39.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.142 0.496 . . . . 0.0 110.216 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.413 ' O ' ' O ' ' A' ' 10' ' ' ALA . 22.8 m-20 -63.27 -20.09 65.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.224 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.413 ' O ' ' O ' ' A' ' 9' ' ' ASP . . . 42.96 -167.9 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.75 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -132.05 -42.48 0.99 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.513 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -158.83 -172.79 26.39 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.43 163.39 1.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.719 0.295 . . . . 0.0 110.613 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -157.45 59.54 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.577 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -124.54 -167.03 1.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.561 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.91 25.36 4.84 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.648 ' ND1' ' N ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -93.55 -22.16 18.99 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.626 179.905 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.648 ' N ' ' ND1' ' A' ' 17' ' ' HIS . . . 21.73 81.09 0.01 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.525 ' C ' ' O ' ' A' ' 18' ' ' GLY . 0.1 OUTLIER 28.84 85.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 110.669 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.577 ' OG ' ' O ' ' A' ' 17' ' ' HIS . 2.5 p 171.62 69.16 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.639 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -77.23 172.9 12.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.495 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.464 ' O ' ' CB ' ' A' ' 26' ' ' ASN . 1.9 pt20 -81.15 -12.43 59.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 3.6 ptt? -67.15 -31.15 71.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.949 0.404 . . . . 0.0 111.211 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.93 -63.95 1.09 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.083 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.615 ' CD2' ' H ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -70.53 -32.95 70.6 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.12 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.573 ' C ' HD21 ' A' ' 26' ' ' ASN . 0.6 OUTLIER -59.26 -59.87 4.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.656 0.741 . . . . 0.0 109.684 179.765 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.415 HE21 ' HB3' ' A' ' 27' ' ' GLN . 1.7 mm100 -54.48 -53.37 55.14 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.981 -1.009 . . . . 0.0 108.985 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.436 ' CD2' HD23 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -45.62 -51.62 11.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.065 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 29' ' ' ARG . 1.7 mtp180 -64.06 -22.23 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.617 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.535 ' OE2' ' ND2' ' A' ' 26' ' ' ASN . 45.0 mt-10 -85.46 -20.2 30.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.847 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.6 mt -93.83 -50.84 11.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.575 0.702 . . . . 0.0 111.396 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.692 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 1.6 p -92.69 -38.0 12.08 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.143 -177.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.692 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 77.42 35.97 35.58 Favored Glycine 0 CA--C 1.522 0.5 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.575 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -90.81 150.5 3.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.054 0.454 . . . . 0.0 111.057 -179.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.38 23.74 12.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.988 -179.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.575 ' H ' HG22 ' A' ' 34' ' ' ILE . 40.1 t0 -120.64 74.37 24.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.156 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -36.07 -25.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.929 2.419 . . . . 0.0 112.177 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -73.13 -51.62 17.28 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.09 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.671 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -70.31 -27.44 64.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.488 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -69.45 -55.94 8.84 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.311 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -58.14 -25.17 61.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.386 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -66.29 -49.1 68.23 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HB3' ' CD2' ' A' ' 58' ' ' LEU . . . -58.14 -44.85 88.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.248 179.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.436 HD23 ' CD2' ' A' ' 28' ' ' LEU . 3.7 mm? -63.05 -34.0 76.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.011 0.434 . . . . 0.0 110.097 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 1.4 tmtm? -72.9 -30.8 64.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.033 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.45 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.42 -28.79 28.61 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.245 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.709 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 1.1 m -84.5 3.59 35.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.423 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m120 68.54 21.31 8.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.166 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.66 0.35 49.43 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.479 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.28 130.57 34.55 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.139 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.495 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -78.01 -52.2 16.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.512 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.495 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 28.5 m -52.26 -53.2 46.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 111.268 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.467 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 mm-40 -59.39 -56.77 17.84 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.427 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.709 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -41.69 -57.31 2.34 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-O 122.193 0.997 . . . . 0.0 108.593 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.483 ' O ' ' CG2' ' A' ' 59' ' ' THR . 2.1 t -43.02 -57.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.454 -1.703 . . . . 0.0 108.324 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.7 t -46.73 -52.94 12.85 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.164 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 13.7 mt -50.18 -38.97 42.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.219 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.471 HD23 ' CE2' ' A' ' 39' ' ' PHE . 21.0 mt -81.03 -53.81 6.1 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.123 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.483 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -56.81 -22.15 34.19 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.557 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 3.0 t70 -97.88 67.22 1.95 Allowed 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.081 178.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.557 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 4.2 tt0 84.25 89.09 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -178.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.482 ' HG3' ' H ' ' A' ' 63' ' ' VAL . 0.9 OUTLIER -107.34 -73.8 0.68 Allowed 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.336 0.589 . . . . 0.0 111.163 -178.59 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.482 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 22.7 t -102.36 -104.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.902 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt 61.22 -122.44 0.84 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.391 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.503 ' CA ' ' OE1' ' A' ' 65' ' ' GLU . 0.2 OUTLIER 174.68 81.67 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.957 0.408 . . . . 0.0 110.875 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.604 ' O ' ' C ' ' A' ' 67' ' ' SER . 71.8 Cg_endo -81.95 -102.54 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 122.883 2.389 . . . . 0.0 111.761 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.604 ' C ' ' O ' ' A' ' 66' ' ' PRO . 22.1 m 6.88 -85.94 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.324 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.586 ' O ' ' O ' ' A' ' 67' ' ' SER . 15.2 mt-30 -44.95 -176.19 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.38 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.615 ' O ' ' O ' ' A' ' 70' ' ' THR . 3.0 m-20 -89.31 -53.57 4.5 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.261 0.553 . . . . 0.0 110.768 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.615 ' O ' ' O ' ' A' ' 69' ' ' ASP . 72.4 p 30.73 -158.91 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.675 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.729 ' CG1' ' H ' ' A' ' 72' ' ' ALA . 2.5 t 28.86 -153.45 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.698 0.761 . . . . 0.0 111.067 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.729 ' H ' ' CG1' ' A' ' 71' ' ' VAL . . . -114.41 -28.36 7.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.212 178.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 72' ' ' ALA . 0.2 OUTLIER -49.78 -170.19 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.108 -1.406 . . . . 0.0 110.869 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.433 ' H ' HG23 ' A' ' 73' ' ' THR . 4.4 pt-20 -104.82 149.03 37.05 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.166 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.13 154.78 57.23 Favored 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.623 2.215 . . . . 0.0 112.117 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.0 m -137.42 85.08 2.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.541 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -107.52 -4.42 18.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.485 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.57 ' O ' ' O ' ' A' ' 79' ' ' GLU . 2.9 t -130.67 -126.45 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.642 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.57 ' O ' ' O ' ' A' ' 78' ' ' VAL . 11.7 mt-10 -26.37 147.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.901 0.381 . . . . 0.0 110.66 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 168.23 -3.59 0.04 OUTLIER Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.548 ' O ' ' O ' ' A' ' 82' ' ' ALA . 0.7 OUTLIER -94.57 -169.05 1.95 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.742 0.306 . . . . 0.0 110.584 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.548 ' O ' ' O ' ' A' ' 81' ' ' SER . . . -40.59 172.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.872 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -177.82 -144.83 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.437 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -66.07 -4.03 6.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.401 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.681 ' O ' ' N ' ' A' ' 87' ' ' VAL . 15.3 tttp -70.79 -80.15 0.06 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.614 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.519 ' O ' ' CG2' ' A' ' 87' ' ' VAL . 0.8 OUTLIER -31.88 -27.73 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.63 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.681 ' N ' ' O ' ' A' ' 85' ' ' LYS . 77.3 t -161.84 128.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.685 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.416 ' O ' ' O ' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -90.55 -29.5 17.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.525 0.678 . . . . 0.0 109.536 179.102 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.416 ' O ' ' O ' ' A' ' 88' ' ' LEU . . . 44.9 -172.16 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.728 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.13 -156.61 0.57 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.43 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.417 ' O ' ' C ' ' A' ' 92' ' ' ILE . 4.1 t 65.73 23.31 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.74 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.417 ' C ' ' O ' ' A' ' 91' ' ' VAL . 3.9 pt -39.02 131.71 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.494 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -168.64 112.63 0.58 Allowed 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.28 0.562 . . . . 0.0 110.195 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.66 ' O ' ' ND2' ' A' ' 98' ' ' ASN . 0.2 OUTLIER -131.53 -52.29 1.0 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.832 -179.059 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.511 ' H ' ' HG ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -76.38 -162.56 0.25 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.24 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.575 ' CG ' ' H ' ' A' ' 97' ' ' ASP . 31.1 t-80 53.88 -125.92 2.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.331 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.575 ' H ' ' CG ' ' A' ' 96' ' ' HIS . 21.3 p-10 -97.05 96.44 8.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.222 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.695 ' O ' ' N ' ' A' ' 100' ' ' ASP . 0.2 OUTLIER -109.32 150.45 27.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.887 -179.623 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.437 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER 40.19 11.22 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.23 179.699 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.695 ' N ' ' O ' ' A' ' 98' ' ' ASN . 3.4 t0 -44.64 -20.36 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.75 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.437 ' N ' ' O ' ' A' ' 99' ' ' LYS . 0.7 OUTLIER -58.71 -60.24 4.13 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.879 -179.552 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.693 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 4.1 pp -82.11 -30.31 31.27 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.478 ' N ' HD11 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.6 0.714 . . . . 0.0 109.881 -178.809 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.549 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -80.94 -48.48 12.24 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.232 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.78 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.693 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -65.63 -42.72 93.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.838 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.12 -48.2 68.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.966 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -38.56 83.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.66 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -20.7 25.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 111.461 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.557 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 23.1 tp -82.31 -26.07 33.37 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.537 0.684 . . . . 0.0 109.459 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.51 -17.9 59.97 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.074 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -106.0 -21.08 13.23 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.989 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.563 ' O ' ' O ' ' A' ' 114' ' ' PRO . 0.1 OUTLIER -106.69 171.2 4.93 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.8 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . 0.563 ' O ' ' O ' ' A' ' 113' ' ' SER . 50.1 Cg_exo -49.11 -128.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.964 2.442 . . . . 0.0 112.34 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -121.28 -93.64 0.52 Allowed 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.269 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.64 145.34 13.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.584 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -130.75 -2.4 4.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.638 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 41.69 -138.58 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.533 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -73.78 -42.39 61.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.619 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.714 0 CA-C-O 118.026 -1.43 . . . . 0.0 110.875 -179.994 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.513 ' O ' ' C ' ' A' ' 2' ' ' THR . 8.8 tpt . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.513 ' C ' ' O ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -29.29 129.86 0.08 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.493 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.6 -107.43 0.34 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.731 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 56.7 tt0 -109.56 -32.25 7.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.968 0.413 . . . . 0.0 110.977 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.783 ' H ' ' CD1' ' A' ' 5' ' ' LEU . 0.0 OUTLIER -68.31 157.26 36.01 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.528 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.518 ' NE2' ' OD1' ' A' ' 9' ' ' ASP . 6.1 tt0 179.85 154.7 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.471 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.42 -15.66 14.96 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.922 0.392 . . . . 0.0 110.635 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -84.36 -63.17 1.39 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.301 0.572 . . . . 0.0 110.332 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.579 ' O ' ' O ' ' A' ' 10' ' ' ALA . 2.4 m-20 -62.32 -21.84 65.59 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.228 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.579 ' O ' ' O ' ' A' ' 9' ' ' ASP . . . -39.36 172.01 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.672 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.04 118.2 30.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.701 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.484 ' O ' ' C ' ' A' ' 13' ' ' ALA . . . -120.83 78.65 0.32 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.484 ' C ' ' O ' ' A' ' 12' ' ' GLY . . . 33.14 -120.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.819 0.342 . . . . 0.0 110.478 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -115.73 64.01 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.375 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.582 ' CG ' ' H ' ' A' ' 16' ' ' GLY . 38.6 t0 66.94 -144.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.503 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.582 ' H ' ' CG ' ' A' ' 15' ' ' ASP . . . -157.89 -177.06 30.64 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -95.73 -80.21 0.43 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.778 0.323 . . . . 0.0 110.574 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.47 -5.76 3.23 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.1 m -133.54 -150.78 0.42 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.806 0.336 . . . . 0.0 110.403 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.5 p -143.34 94.22 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.337 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.637 ' O ' ' N ' ' A' ' 23' ' ' MET . 3.5 m -128.59 -161.62 1.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.882 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -42.76 -12.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.667 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.637 ' N ' ' O ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -56.62 -57.89 10.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.179 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.639 ' O ' ' CD2' ' A' ' 28' ' ' LEU . 10.4 mt -52.28 -63.17 1.23 Allowed 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.411 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.685 ' CD2' ' H ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -51.23 -53.28 36.7 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.926 -179.203 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -56.16 -47.53 78.06 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.559 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.91 -63.55 1.17 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.763 -178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.639 ' CD2' ' O ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -53.26 -51.65 61.57 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.302 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -23.01 63.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.631 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.29 -44.12 16.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.433 HD13 HG22 ' A' ' 31' ' ' ILE . 63.1 mt -69.81 -54.78 17.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.416 0.627 . . . . 0.0 111.438 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.511 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 4.7 p -76.13 -36.59 58.75 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.553 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.509 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 72.2 36.15 60.24 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.533 HD12 ' CZ ' ' A' ' 39' ' ' PHE . 1.7 mm -90.62 151.29 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.173 0.511 . . . . 0.0 111.703 -178.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -119.33 23.26 11.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.707 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.631 ' O ' ' N ' ' A' ' 38' ' ' SER . 46.5 t0 -120.37 69.92 15.85 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.212 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -36.94 -21.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.753 2.302 . . . . 0.0 111.707 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -75.41 -52.74 10.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.356 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.677 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -69.22 -26.23 64.71 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.506 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 14.1 mt -66.33 -55.93 13.6 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -50.85 -37.18 41.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.598 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -58.22 -45.37 87.81 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.433 ' CB ' HD13 ' A' ' 58' ' ' LEU . . . -58.26 -54.11 50.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.027 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.552 HD23 ' H ' ' A' ' 44' ' ' LEU . 3.8 mm? -62.64 -20.22 64.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.278 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -79.01 -54.13 6.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.973 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.26 -29.48 69.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.489 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 4.0 p -76.15 -16.75 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m120 68.24 33.37 4.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.498 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.48 -20.97 42.63 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.489 ' O ' ' OG ' ' A' ' 47' ' ' SER . 36.0 m-20 -68.53 118.46 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.5 HG21 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -74.18 -53.17 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.52 -179.726 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.5 ' N ' HG21 ' A' ' 51' ' ' ILE . 39.3 m -45.76 -55.52 6.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.344 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.35 -57.35 11.6 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.674 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.409 ' O ' HD11 ' A' ' 58' ' ' LEU . . . -41.86 -47.65 4.26 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 109.785 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.485 ' O ' ' CG2' ' A' ' 59' ' ' THR . 24.6 t -53.95 -59.75 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.817 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -54.59 -44.82 73.37 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.806 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.3 mt -58.09 -36.23 72.56 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.485 0.66 . . . . 0.0 110.893 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.593 ' HG ' ' CE2' ' A' ' 39' ' ' PHE . 7.2 mp -84.35 -40.23 18.14 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.787 -1.097 . . . . 0.0 113.268 -177.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.738 ' C ' ' H ' ' A' ' 61' ' ' GLU . 1.5 t -97.09 8.72 43.91 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.84 -178.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.582 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 0.4 OUTLIER -57.5 17.31 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.965 -0.294 . . . . 0.0 110.812 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.738 ' H ' ' C ' ' A' ' 59' ' ' THR . 5.2 tt0 87.97 52.88 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 120.799 0.333 . . . . 0.0 110.879 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.672 ' O ' ' N ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -124.44 -63.08 1.21 Allowed 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 121.126 0.488 . . . . 0.0 111.372 -179.744 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.471 ' H ' ' HG2' ' A' ' 62' ' ' ARG . 2.8 t -40.2 -13.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.129 -179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.672 ' N ' ' O ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -137.93 155.85 48.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.986 0.422 . . . . 0.0 110.577 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.609 ' O ' ' O ' ' A' ' 66' ' ' PRO . 53.8 mp0 -131.28 133.94 25.14 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.205 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.609 ' O ' ' O ' ' A' ' 65' ' ' GLU . 52.5 Cg_exo -46.95 -130.15 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.451 2.1 . . . . 0.0 112.643 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.479 ' O ' ' C ' ' A' ' 68' ' ' GLN . 11.0 p 42.97 32.52 0.42 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.361 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.796 HE21 ' H ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -33.69 148.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.684 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.796 ' H ' HE21 ' A' ' 68' ' ' GLN . 5.9 m-20 -80.83 -29.28 35.95 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.499 0.666 . . . . 0.0 110.461 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.7 p -119.5 131.92 55.67 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.289 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.1 m -144.96 129.9 13.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.654 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.582 ' O ' ' OG1' ' A' ' 73' ' ' THR . . . -49.74 -36.34 25.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.235 0.54 . . . . 0.0 110.306 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.582 ' OG1' ' O ' ' A' ' 72' ' ' ALA . 84.9 m -176.52 -67.14 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.564 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.404 ' C ' ' O ' ' A' ' 73' ' ' THR . 0.9 OUTLIER -36.79 102.73 0.24 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.265 -179.731 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -82.5 163.74 16.74 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.653 2.235 . . . . 0.0 111.754 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.43 -157.74 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.904 0.383 . . . . 0.0 110.632 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.543 ' N ' ' CD ' ' A' ' 77' ' ' GLU . 22.0 mp0 -127.65 -101.37 0.35 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.757 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.773 ' CG2' ' H ' ' A' ' 79' ' ' GLU . 10.0 p -163.67 -146.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.346 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.773 ' H ' ' CG2' ' A' ' 78' ' ' VAL . 87.2 mt-10 -142.8 -76.23 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.769 0.318 . . . . 0.0 110.779 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -107.49 176.73 21.04 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.4 m -111.76 -174.26 2.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.827 0.346 . . . . 0.0 110.671 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -49.16 168.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.856 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -126.99 -153.94 0.6 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.545 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -100.25 13.59 33.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.611 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.603 ' C ' ' H ' ' A' ' 87' ' ' VAL . 0.0 OUTLIER -111.09 -157.98 0.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.484 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 62.96 -8.93 0.12 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.042 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.603 ' H ' ' C ' ' A' ' 85' ' ' LYS . 97.8 t -143.03 132.78 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.925 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.509 ' O ' ' O ' ' A' ' 89' ' ' ALA . 1.3 tt -90.92 -31.53 16.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.62 0.724 . . . . 0.0 109.63 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.509 ' O ' ' O ' ' A' ' 88' ' ' LEU . . . 50.28 165.56 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.131 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.489 ' HA ' ' HZ2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -111.43 -144.46 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.045 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.414 ' O ' ' O ' ' A' ' 92' ' ' ILE . 14.2 p -128.14 6.03 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.906 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.414 ' O ' ' O ' ' A' ' 91' ' ' VAL . 17.3 pt -41.38 162.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.384 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -178.75 113.62 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.971 0.415 . . . . 0.0 110.59 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.638 ' CD1' ' N ' ' A' ' 95' ' ' THR . 4.2 pp -117.62 -50.38 2.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.673 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.638 ' N ' ' CD1' ' A' ' 94' ' ' LEU . 0.9 OUTLIER -52.12 -148.18 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.558 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.517 ' H ' ' CG2' ' A' ' 95' ' ' THR . 61.7 m-70 -162.13 179.9 7.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.343 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.555 ' O ' ' O ' ' A' ' 98' ' ' ASN . 4.4 p-10 31.76 39.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.038 0.447 . . . . 0.0 110.172 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.555 ' O ' ' O ' ' A' ' 97' ' ' ASP . 26.5 m120 -52.18 -122.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.925 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.481 ' CG ' ' H ' ' A' ' 100' ' ' ASP . 7.3 pttm -137.34 -110.93 0.18 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.282 0.563 . . . . 0.0 111.947 -178.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.579 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -61.29 -25.27 66.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.577 -178.951 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.81 -60.9 2.89 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.091 -179.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.783 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.95 -19.71 36.65 Favored 'General case' 0 C--O 1.216 -0.666 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.442 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.506 ' N ' HD23 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -67.77 -36.69 80.95 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.504 -0.879 . . . . 0.0 108.769 179.041 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.34 -52.36 8.21 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.516 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.57 -45.5 85.11 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.679 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.1 mm -62.73 -45.8 97.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.988 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.06 91.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.247 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.26 -40.53 94.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.843 0.354 . . . . 0.0 110.346 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -18.02 32.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.902 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.559 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.2 tm? -93.73 -12.05 30.07 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.62 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.68 -21.11 66.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.452 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -68.37 -79.94 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.533 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.79 102.51 35.41 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.509 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -76.79 171.3 18.25 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 122.387 2.058 . . . . 0.0 111.92 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -159.74 -165.07 1.44 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.985 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.481 ' C ' ' H ' ' A' ' 118' ' ' ALA . 0.8 OUTLIER -134.52 -177.82 2.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.288 179.909 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.486 ' N ' ' CD ' ' A' ' 117' ' ' GLN . 3.7 mp0 -76.72 33.46 0.14 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.702 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.481 ' H ' ' C ' ' A' ' 116' ' ' ILE . . . 37.22 -138.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.659 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.536 ' C ' ' OD1' ' A' ' 119' ' ' ASP . 25.3 t0 -174.25 -74.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.571 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.696 0 CA-C-O 118.045 -1.42 . . . . 0.0 110.864 -179.973 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptm . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.1 m -67.32 -30.19 69.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.614 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 39.65 -139.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.623 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.06 -178.43 0.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.57 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.652 ' CD2' ' H ' ' A' ' 5' ' ' LEU . 0.6 OUTLIER -85.16 158.33 20.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.527 ' C ' ' H ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER -78.28 -57.18 3.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.323 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 71.73 -14.85 0.48 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.527 ' H ' ' C ' ' A' ' 6' ' ' GLN . 0.8 OUTLIER -103.75 -19.56 14.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.385 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.598 ' O ' ' C ' ' A' ' 10' ' ' ALA . 1.6 m-20 -80.13 -41.03 26.2 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.472 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.598 ' C ' ' O ' ' A' ' 9' ' ' ASP . . . 13.9 -114.15 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.072 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.541 ' O ' ' C ' ' A' ' 12' ' ' GLY . . . -80.16 -113.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.171 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.541 ' C ' ' O ' ' A' ' 11' ' ' ALA . . . 26.66 56.77 0.09 OUTLIER Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' C ' ' A' ' 14' ' ' ALA . . . -143.65 -142.63 0.14 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 110.385 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' A' ' 13' ' ' ALA . . . -36.59 146.56 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.434 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -67.75 -138.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.588 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.78 179.15 21.38 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 62.4 m170 -107.27 -84.11 0.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.746 0.308 . . . . 0.0 110.359 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.57 ' O ' ' C ' ' A' ' 19' ' ' SER . . . 69.56 -151.18 50.48 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.294 -0.722 . . . . 0.0 111.294 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.57 ' C ' ' O ' ' A' ' 18' ' ' GLY . 0.7 OUTLIER -15.22 115.7 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.81 0.338 . . . . 0.0 111.396 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.58 93.43 2.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -116.35 169.58 9.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.554 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -83.47 -19.03 36.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.048 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.3 ttm -60.34 -43.02 96.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.899 0.38 . . . . 0.0 111.82 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.487 HD23 ' H ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -54.17 -64.06 0.95 Allowed 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.2 -178.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -32.99 72.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.832 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -63.17 -59.09 5.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.149 0.499 . . . . 0.0 110.649 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -58.88 -61.29 2.74 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.489 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.429 ' CD1' ' HG ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -45.49 -55.78 5.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.803 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -67.31 -20.94 65.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.61 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -80.75 -24.14 38.9 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.449 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.2 mt -95.8 -54.83 6.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.571 0.7 . . . . 0.0 111.062 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.688 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 5.8 p -78.88 -37.92 38.94 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.78 -178.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.688 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 78.79 36.04 30.02 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.549 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -98.74 144.78 11.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.789 0.328 . . . . 0.0 110.964 -179.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.545 ' OE1' ' N ' ' A' ' 35' ' ' GLN . 3.3 mp0 -113.35 22.7 13.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.638 ' O ' ' N ' ' A' ' 38' ' ' SER . 1.5 m-20 -111.46 71.6 0.89 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.354 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' CG ' ' A' ' 41' ' ' HIS . 78.2 Cg_exo -35.31 -22.71 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.752 2.301 . . . . 0.0 111.92 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.638 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -74.06 -49.59 23.41 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.869 179.881 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.658 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -73.92 -29.83 62.25 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.48 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.7 mp -69.96 -49.81 48.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.462 -0.79 . . . . 0.0 108.87 177.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.442 ' CG ' ' O ' ' A' ' 37' ' ' PRO . 18.5 m170 -67.06 -24.02 65.93 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.464 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -68.17 -39.02 82.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.417 ' HB1' ' CB ' ' A' ' 54' ' ' ALA . . . -63.87 -50.12 70.06 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.963 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.429 ' HG ' ' CD1' ' A' ' 28' ' ' LEU . 81.7 mt -65.4 -24.38 67.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.942 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.8 -31.2 45.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.174 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.9 -35.6 26.01 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.928 0.394 . . . . 0.0 110.076 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.57 ' O ' ' OD1' ' A' ' 48' ' ' ASN . 72.3 p -84.28 12.55 6.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.705 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 47' ' ' SER . 24.0 p30 47.4 37.98 6.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.778 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.36 -24.0 32.42 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.244 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.09 104.46 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 117.267 0.534 . . . . 0.0 109.981 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.645 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.3 OUTLIER -60.77 -55.58 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.183 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.645 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.9 m -40.88 -57.55 1.93 Allowed 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.322 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 54' ' ' ALA . 8.6 mt-30 -51.18 -55.01 20.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.696 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.419 ' CB ' HD23 ' A' ' 44' ' ' LEU . . . -41.75 -44.63 3.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.46 0.648 . . . . 0.0 109.704 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.484 ' O ' ' CG2' ' A' ' 59' ' ' THR . 13.7 t -59.22 -59.6 3.61 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.75 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.567 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 22.3 t -52.95 -38.15 61.77 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.593 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.697 ' O ' ' NE ' ' A' ' 62' ' ' ARG . 8.7 mt -67.34 -40.56 85.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.264 0.554 . . . . 0.0 111.285 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.584 ' CD2' ' CZ ' ' A' ' 39' ' ' PHE . 6.9 mp -80.37 -38.98 29.37 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.682 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.507 ' O ' ' C ' ' A' ' 60' ' ' ASP . 1.3 t -98.71 -10.94 22.46 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.756 -178.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.567 ' OD1' ' O ' ' A' ' 56' ' ' SER . 0.4 OUTLIER -34.82 -86.67 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.208 0.527 . . . . 0.0 109.85 179.445 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.491 ' H ' ' HD2' ' A' ' 62' ' ' ARG . 1.7 tt0 -152.87 61.44 0.79 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.948 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.697 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -129.56 -93.5 0.43 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.349 0.595 . . . . 0.0 111.092 -179.13 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.587 ' H ' ' CG ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -51.92 -86.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.585 -179.669 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.599 ' HZ3' ' CB ' ' A' ' 64' ' ' LYS . 0.6 OUTLIER 53.74 -177.75 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.396 179.73 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.66 ' OE1' ' N ' ' A' ' 65' ' ' GLU . 1.8 mp0 -73.03 148.35 89.03 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.504 ' O ' ' C ' ' A' ' 67' ' ' SER . 11.3 Cg_endo -56.37 -146.34 0.0 OUTLIER 'Trans proline' 0 C--N 1.302 -1.912 0 C-N-CA 122.424 2.083 . . . . 0.0 111.53 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.504 ' C ' ' O ' ' A' ' 66' ' ' PRO . 11.7 p 31.5 39.65 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.846 0.355 . . . . 0.0 110.622 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 66' ' ' PRO . 2.2 tt0 -172.06 13.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.323 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -76.81 -23.91 52.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.141 0.496 . . . . 0.0 110.855 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -153.86 134.47 13.62 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.521 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.91 149.18 33.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.573 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.602 ' O ' ' OG1' ' A' ' 73' ' ' THR . . . -103.61 -40.19 6.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.218 0.533 . . . . 0.0 109.98 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.602 ' OG1' ' O ' ' A' ' 72' ' ' ALA . 99.6 m -176.67 -37.67 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.669 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.612 ' O ' ' O ' ' A' ' 75' ' ' PRO . 30.2 mt-10 -82.15 149.62 62.81 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.844 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.612 ' O ' ' O ' ' A' ' 74' ' ' GLU . 42.4 Cg_exo -48.29 -138.91 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.719 2.279 . . . . 0.0 112.592 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.4 p -76.96 175.32 9.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.412 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -46.07 -77.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.397 0.618 . . . . 0.0 110.368 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.758 ' CG2' ' H ' ' A' ' 79' ' ' GLU . 9.9 p -113.68 -147.83 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.383 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.758 ' H ' ' CG2' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -98.6 -59.85 1.66 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.811 0.338 . . . . 0.0 110.641 -179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 124.98 -36.97 2.68 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 21.4 m -133.62 179.38 6.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.771 0.319 . . . . 0.0 110.574 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -46.36 171.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.745 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -93.33 160.19 14.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.7 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.6 m-20 -120.59 14.69 11.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.481 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 166.86 12.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.309 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -60.65 -17.65 48.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.103 0.477 . . . . 0.0 110.271 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 2.7 t -145.6 152.94 13.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.135 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.534 ' O ' ' CB ' ' A' ' 89' ' ' ALA . 6.1 tt -71.31 -26.74 62.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.138 0.494 . . . . 0.0 110.471 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 88' ' ' LEU . . . 84.01 -7.92 1.03 Allowed 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.052 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.47 ' H ' HD22 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -167.58 113.72 0.73 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.402 179.383 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.46 ' CG1' ' H ' ' A' ' 92' ' ' ILE . 5.4 p 179.26 -54.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.712 ' CG2' ' H ' ' A' ' 93' ' ' ASP . 19.5 mt 56.46 -170.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.536 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.712 ' H ' ' CG2' ' A' ' 92' ' ' ILE . 26.7 t0 73.1 96.75 0.07 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.205 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.8 ' CD2' ' H ' ' A' ' 95' ' ' THR . 1.1 pt? -137.41 -49.05 0.59 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.403 0.62 . . . . 0.0 110.789 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.8 ' H ' ' CD2' ' A' ' 94' ' ' LEU . 3.0 t -68.8 115.07 7.72 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.363 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -123.77 -166.98 1.55 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.645 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.92 -175.12 5.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.45 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -81.13 -20.26 41.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.985 0.421 . . . . 0.0 110.638 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.495 ' C ' ' H ' ' A' ' 101' ' ' ASP . 0.3 OUTLIER -94.46 10.19 35.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.564 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.536 ' C ' ' OD1' ' A' ' 100' ' ' ASP . 34.4 p30 -48.3 -14.15 0.05 Allowed 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.027 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.535 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 0.1 OUTLIER -59.81 -61.57 2.52 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.056 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.704 ' CD2' ' N ' ' A' ' 103' ' ' GLN . 0.5 OUTLIER -83.23 -28.83 28.94 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.486 179.458 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.704 ' N ' ' CD2' ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.26 -39.03 93.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.912 0.863 . . . . 0.0 109.364 -179.204 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.475 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -80.31 -54.64 5.54 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.141 -1.39 . . . . 0.0 111.169 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.41 -44.34 76.13 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.351 0.596 . . . . 0.0 109.471 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.668 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -67.37 -41.86 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.364 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.51 89.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -38.97 89.6 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.178 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.65 -18.04 34.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.098 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.566 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.3 tm? -97.02 -11.41 24.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.791 -179.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.67 ' C ' ' H ' ' A' ' 113' ' ' SER . 20.2 mt -121.81 -170.43 2.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.349 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 63.13 -23.01 0.06 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.765 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.67 ' H ' ' C ' ' A' ' 111' ' ' LEU . 13.9 m -136.94 136.66 21.49 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.841 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -76.68 -175.01 2.38 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 C-N-CA 122.525 2.15 . . . . 0.0 111.907 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.473 ' H ' ' CD ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -111.82 -165.69 1.01 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.774 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.712 ' CG2' ' H ' ' A' ' 117' ' ' GLN . 8.9 mt -144.06 -153.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.232 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.712 ' H ' ' CG2' ' A' ' 116' ' ' ILE . 0.0 OUTLIER -68.08 81.8 0.22 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.416 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -55.91 -166.87 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.466 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.9 -78.37 0.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.579 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.801 0 CA-C-O 117.972 -1.46 . . . . 0.0 110.995 179.921 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.1 m -157.22 135.28 11.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.663 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.59 -176.63 4.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.27 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.463 ' O ' ' O ' ' A' ' 5' ' ' LEU . 22.4 tp10 56.8 -120.19 1.37 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.279 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.463 ' O ' ' O ' ' A' ' 4' ' ' GLU . 0.2 OUTLIER -48.67 -178.92 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.199 179.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.546 ' C ' ' H ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER -130.51 -127.37 0.2 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.806 0.336 . . . . 0.0 110.744 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 74.39 -19.1 0.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.15 0.5 . . . . 0.0 110.227 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.546 ' H ' ' C ' ' A' ' 6' ' ' GLN . 0.3 OUTLIER -110.54 -20.17 12.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.342 179.503 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.44 ' C ' ' H ' ' A' ' 11' ' ' ALA . 33.0 m-20 -43.38 -20.67 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.458 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.482 ' N ' ' O ' ' A' ' 8' ' ' ASP . . . -58.51 -8.56 1.27 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.44 ' H ' ' C ' ' A' ' 9' ' ' ASP . . . -84.59 -177.58 6.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.461 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 116.23 165.34 14.17 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -139.37 170.32 16.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.877 0.37 . . . . 0.0 110.632 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.66 27.4 1.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.577 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.661 ' OD1' ' N ' ' A' ' 16' ' ' GLY . 13.1 t70 42.77 -120.83 0.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.803 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.661 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 95.73 -128.34 9.49 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.534 ' N ' ' ND1' ' A' ' 17' ' ' HIS . 0.9 OUTLIER -112.91 101.18 9.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.759 0.314 . . . . 0.0 110.542 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -88.76 -172.3 46.39 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.99 9.66 6.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.755 0.312 . . . . 0.0 110.638 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.9 p -112.88 175.67 5.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.328 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 m -134.56 100.74 4.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.867 0.365 . . . . 0.0 110.754 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.482 ' O ' ' CD1' ' A' ' 25' ' ' LEU . 83.9 mt-30 -82.36 -14.1 55.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.559 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.649 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -69.09 -21.63 64.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.488 -179.138 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.597 ' O ' ' CD2' ' A' ' 28' ' ' LEU . 71.1 mt -65.46 -66.24 0.57 Allowed 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.831 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.579 ' N ' HD11 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -67.64 -34.85 77.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.296 179.819 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.554 ' H ' HD11 ' A' ' 25' ' ' LEU . 16.8 t-20 -65.77 -41.8 91.63 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.299 0.571 . . . . 0.0 110.082 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.649 ' CG ' ' O ' ' A' ' 23' ' ' MET . 30.2 mm-40 -61.49 -55.52 30.26 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.621 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.597 ' CD2' ' O ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -52.6 -55.08 24.86 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.594 -179.386 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.426 ' CD ' ' C ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -63.54 -21.63 66.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.352 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -87.64 -20.32 26.5 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.462 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.0 mt -97.43 -53.53 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-O 121.529 0.68 . . . . 0.0 111.085 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.69 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 3.1 p -77.85 -36.65 49.69 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.95 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.69 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 74.2 35.78 52.33 Favored Glycine 0 CA--C 1.519 0.288 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.533 HG23 ' CE1' ' A' ' 39' ' ' PHE . 1.8 mm -92.72 155.64 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.118 0.485 . . . . 0.0 111.68 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.482 ' H ' HG21 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -118.9 23.2 11.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.41 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.575 ' O ' ' N ' ' A' ' 38' ' ' SER . 4.5 m-20 -125.27 75.94 68.3 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.979 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -39.26 -20.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.597 2.198 . . . . 0.0 111.563 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.575 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -73.67 -53.89 9.37 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.676 -179.407 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.641 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -70.94 -25.6 62.81 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.569 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.577 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 9.6 mt -64.74 -54.68 27.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.457 ' CD2' ' O ' ' A' ' 41' ' ' HIS . 5.6 t-160 -57.81 -30.59 65.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.088 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.18 -44.35 95.63 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.422 ' CB ' ' CD1' ' A' ' 58' ' ' LEU . . . -65.82 -42.36 90.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.259 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -62.5 -31.97 72.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.146 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.424 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.31 -29.39 34.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.183 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.479 ' C ' ' H ' ' A' ' 48' ' ' ASN . . . -77.45 -42.48 35.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.393 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.777 ' HG ' ' CB ' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -72.41 14.13 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.653 0.263 . . . . 0.0 111.007 -179.39 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.666 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.7 OUTLIER 60.42 26.32 15.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.473 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.27 -23.38 34.54 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.48 127.52 31.9 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.595 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.4 OUTLIER -77.56 -57.63 5.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.125 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.595 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 14.4 m -47.84 -45.98 30.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.065 0.46 . . . . 0.0 110.506 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.478 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 41.8 mt-30 -61.71 -55.8 26.46 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.777 ' CB ' ' HG ' ' A' ' 47' ' ' SER . . . -41.47 -58.29 1.94 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.139 0.971 . . . . 0.0 108.511 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.495 ' O ' ' CG2' ' A' ' 59' ' ' THR . 18.1 t -43.56 -54.38 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.754 178.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.432 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 4.5 t -52.43 -44.95 65.74 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.612 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.664 ' O ' ' NE ' ' A' ' 62' ' ' ARG . 16.9 mt -57.45 -34.59 69.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.26 0.552 . . . . 0.0 110.888 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.47 ' CD2' ' CE2' ' A' ' 39' ' ' PHE . 13.8 mt -87.84 -26.89 22.57 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -177.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.651 ' C ' ' H ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -105.96 3.79 28.77 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.094 -0.643 . . . . 0.0 111.26 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.455 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.4 OUTLIER -65.49 30.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.881 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.651 ' H ' ' C ' ' A' ' 59' ' ' THR . 3.1 tp10 75.58 66.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.559 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.664 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -133.64 -73.63 0.49 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.156 0.503 . . . . 0.0 111.751 -179.297 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.573 ' O ' ' O ' ' A' ' 64' ' ' LYS . 84.0 t -63.5 -92.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.558 -178.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.573 ' O ' ' O ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER 35.87 -163.55 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.29 -179.191 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -177.82 76.18 0.23 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.031 0.443 . . . . 0.0 110.806 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.572 ' O ' ' O ' ' A' ' 67' ' ' SER . 12.1 Cg_exo -66.98 -77.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.76 0 C-N-CA 122.85 2.367 . . . . 0.0 111.925 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 66' ' ' PRO . 5.4 p -26.68 150.04 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.922 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -76.05 135.81 39.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.5 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.69 -18.49 29.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.206 0.527 . . . . 0.0 110.613 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.567 ' OG1' ' N ' ' A' ' 71' ' ' VAL . 1.5 t -77.62 -119.98 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.479 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.567 ' N ' ' OG1' ' A' ' 70' ' ' THR . 13.7 m -69.24 -138.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.369 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.586 ' O ' ' C ' ' A' ' 73' ' ' THR . . . -138.59 -37.99 0.53 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.489 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.586 ' C ' ' O ' ' A' ' 72' ' ' ALA . 21.6 m 11.08 -119.5 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.31 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.506 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.2 OUTLIER -45.11 144.06 2.21 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.476 -179.969 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.42 179.74 5.59 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 122.65 2.233 . . . . 0.0 112.187 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.62 -176.95 3.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.576 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -94.81 -102.56 0.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.097 0.475 . . . . 0.0 110.784 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.6 t -148.94 -137.67 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.576 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -132.25 -42.18 0.98 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -153.84 101.26 0.21 Allowed Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -175.55 1.68 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.822 0.344 . . . . 0.0 110.456 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -49.85 -76.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.571 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -176.94 -131.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.671 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -98.95 9.41 43.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.395 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 87' ' ' VAL . 37.2 tttp -94.44 -91.91 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 110.792 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.473 ' O ' ' CG2' ' A' ' 87' ' ' VAL . 4.9 pt-20 33.12 28.9 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.948 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 85' ' ' LYS . 88.2 t -158.32 142.47 6.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.817 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.1 mp -89.89 -36.9 14.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.417 0.627 . . . . 0.0 109.972 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 57.51 75.68 0.36 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.268 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.415 ' O ' ' HB ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER 56.61 -143.42 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.108 179.086 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.468 ' CG1' ' O ' ' A' ' 91' ' ' VAL . 25.7 t 64.47 78.86 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.539 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.467 ' O ' ' O ' ' A' ' 91' ' ' VAL . 23.3 pt -42.38 168.76 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.472 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.407 ' C ' ' OD1' ' A' ' 93' ' ' ASP . 10.4 t0 175.26 94.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.395 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -123.99 -86.58 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.77 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.521 ' O ' ' OG1' ' A' ' 95' ' ' THR . 0.0 OUTLIER -111.56 53.24 0.72 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.629 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -143.45 -21.52 0.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.138 0.494 . . . . 0.0 110.398 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -144.61 66.74 1.26 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.578 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.4 ' OD1' ' C ' ' A' ' 98' ' ' ASN . 17.5 p30 -96.24 153.85 17.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.546 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.597 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -141.53 0.49 1.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.85 -179.755 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.465 ' O ' ' CB ' ' A' ' 104' ' ' ALA . 8.1 m-20 -44.56 -14.65 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.741 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.597 ' N ' ' O ' ' A' ' 99' ' ' LYS . 12.0 t70 -61.12 -60.92 3.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.311 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.686 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 0.4 OUTLIER -83.42 -29.04 28.43 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 120.244 -0.582 . . . . 0.0 110.705 179.786 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.685 ' N ' ' CD2' ' A' ' 102' ' ' LEU . 0.1 OUTLIER -64.4 -40.72 96.34 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.529 -0.869 . . . . 0.0 109.341 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.465 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -79.74 -55.59 4.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.919 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.88 -46.61 71.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.159 0.504 . . . . 0.0 109.669 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.686 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.3 mm -62.58 -47.93 90.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.996 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.29 98.58 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.223 -178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -41.02 98.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -18.37 36.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.091 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.562 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.2 tm? -93.73 -12.05 30.08 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.528 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.72 -29.1 25.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.592 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.5 ' O ' ' CB ' ' A' ' 113' ' ' SER . 54.1 mm-40 -90.91 -94.12 0.13 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.552 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 112' ' ' GLU . 1.9 t 81.37 115.39 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.706 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -76.28 -176.16 2.93 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.231 1.954 . . . . 0.0 112.068 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -123.98 151.62 43.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.627 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.409 HG22 HD13 ' A' ' 116' ' ' ILE . 0.5 OUTLIER -91.2 -169.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.358 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -118.0 39.59 3.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.691 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.39 -111.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.392 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.557 ' CG ' ' N ' ' A' ' 120' ' ' GLY . 7.9 t70 -154.15 -104.41 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.587 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.557 ' N ' ' CG ' ' A' ' 119' ' ' ASP . . . . . . . . 0 C--O 1.22 -0.741 0 CA-C-O 118.0 -1.445 . . . . 0.0 110.821 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.78 -166.33 1.57 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.822 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.8 -36.58 3.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.186 0.517 . . . . 0.0 110.527 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -84.84 -116.33 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.611 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.636 ' N ' ' CD2' ' A' ' 5' ' ' LEU . 2.9 mm? 51.87 178.99 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.371 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -158.7 53.46 0.42 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.569 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -76.0 3.65 9.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.506 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.433 ' O ' ' C ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -95.17 -18.6 20.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.544 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.675 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 1.8 p-10 -35.66 -61.54 0.46 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.963 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.675 ' N ' ' CG ' ' A' ' 9' ' ' ASP . . . 32.89 99.08 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.252 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -113.79 120.36 40.52 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.903 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -99.88 128.79 9.69 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ASP . . . -104.02 -165.78 1.19 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.816 0.341 . . . . 0.0 110.43 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.548 ' O ' ' C ' ' A' ' 15' ' ' ASP . . . -67.43 72.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.301 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.548 ' C ' ' O ' ' A' ' 14' ' ' ALA . 2.2 m-20 -25.53 -75.61 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.759 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 140.38 -9.06 2.93 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -79.9 150.86 30.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.788 0.328 . . . . 0.0 110.41 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.06 121.92 2.02 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.6 t -87.62 176.83 7.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.733 0.301 . . . . 0.0 110.537 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 t -150.15 113.01 4.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.464 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.523 ' C ' ' H ' ' A' ' 23' ' ' MET . 0.1 OUTLIER -128.07 145.61 50.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.956 0.408 . . . . 0.0 110.825 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -47.2 -12.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.644 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.744 ' N ' ' SD ' ' A' ' 23' ' ' MET . 0.0 OUTLIER -65.68 -47.86 74.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.147 0.499 . . . . 0.0 110.907 -179.631 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.405 ' H ' HD11 ' A' ' 24' ' ' LEU . 3.6 mp -61.98 -48.59 79.67 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.071 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.577 ' CD2' ' H ' ' A' ' 25' ' ' LEU . 1.9 mm? -62.53 -52.96 61.4 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.158 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -53.4 -45.97 69.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.379 0.609 . . . . 0.0 110.118 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' N ' ' A' ' 30' ' ' GLU . 2.6 mm-40 -57.32 -58.77 6.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.835 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 44' ' ' LEU . 12.4 tp -44.68 -54.27 6.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.97 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -63.03 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.374 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 27' ' ' GLN . 29.6 tt0 -79.29 -21.21 46.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.998 0.428 . . . . 0.0 110.398 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.446 HG21 HD13 ' A' ' 31' ' ' ILE . 59.4 mt -93.96 -44.29 13.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.383 0.611 . . . . 0.0 111.215 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.564 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 3.1 p -91.44 -37.45 13.18 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.312 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.564 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 86.99 34.77 10.48 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.533 ' CG1' ' OG1' ' A' ' 32' ' ' THR . 1.1 mm -100.09 142.27 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.773 0.321 . . . . 0.0 110.39 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.591 HE22 ' C ' ' A' ' 79' ' ' GLU . 2.9 mp0 -113.85 23.29 13.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.792 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.635 ' O ' ' N ' ' A' ' 38' ' ' SER . 36.4 t0 -112.52 72.51 1.31 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -34.96 -22.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.691 0 C-N-CA 122.877 2.385 . . . . 0.0 112.336 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.635 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.8 OUTLIER -73.68 -52.66 12.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.938 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.685 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -72.26 -26.01 61.83 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.457 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mp -71.91 -53.17 13.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -60.72 -24.92 66.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.128 178.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -65.79 -46.11 79.93 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.418 ' HB3' ' CD2' ' A' ' 58' ' ' LEU . . . -61.53 -51.52 68.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.071 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.447 ' CD2' ' CD2' ' A' ' 28' ' ' LEU . 4.3 mm? -55.04 -36.27 65.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.207 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 4.4 tmtt? -76.54 -28.74 56.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.446 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.462 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.32 -20.88 33.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.914 0.388 . . . . 0.0 110.735 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 48' ' ' ASN . 42.2 t -93.02 -6.83 47.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.381 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.677 ' N ' HD21 ' A' ' 48' ' ' ASN . 0.2 OUTLIER 74.75 26.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.055 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.12 -21.59 41.07 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.35 123.64 20.93 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.639 ' CG2' ' N ' ' A' ' 52' ' ' THR . 2.2 tt -75.56 -56.03 9.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.036 -179.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.639 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.2 m -46.09 -52.34 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.809 0.337 . . . . 0.0 110.662 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.5 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 28.1 mt-30 -59.64 -53.68 55.23 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.37 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.0 -53.52 2.95 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.457 ' O ' ' CG2' ' A' ' 59' ' ' THR . 39.5 t -47.73 -58.73 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.949 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.2 t -46.02 -48.53 16.74 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.249 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.665 ' O ' ' NE ' ' A' ' 62' ' ' ARG . 6.6 mp -62.53 -27.64 69.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.199 0.523 . . . . 0.0 111.02 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.547 ' CD2' ' CZ ' ' A' ' 39' ' ' PHE . 52.6 mt -90.31 -14.02 34.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.853 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.672 ' C ' ' H ' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -118.2 -0.22 11.6 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.329 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.478 ' H ' ' HD3' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -64.63 27.14 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.771 0.32 . . . . 0.0 110.598 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.672 ' H ' ' C ' ' A' ' 59' ' ' THR . 1.0 OUTLIER 79.52 36.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.362 179.448 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.665 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -91.64 -52.21 4.87 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 121.329 0.585 . . . . 0.0 110.379 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.433 ' O ' ' CD ' ' A' ' 64' ' ' LYS . 48.6 t -95.01 -107.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.589 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.49 ' HB3' ' H ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER 173.72 -105.04 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.517 179.046 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.8 ' H ' ' CD ' ' A' ' 66' ' ' PRO . 0.0 OUTLIER 177.23 -18.43 0.0 OUTLIER Pre-proline 0 CA--C 1.546 0.81 0 N-CA-C 114.22 1.193 . . . . 0.0 114.22 -179.302 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.8 ' CD ' ' H ' ' A' ' 65' ' ' GLU . 51.3 Cg_exo -55.2 -151.8 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.221 0 C-N-CA 121.953 1.769 . . . . 0.0 112.893 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.654 ' OG ' ' N ' ' A' ' 68' ' ' GLN . 5.1 t 169.01 -166.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.587 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.654 ' N ' ' OG ' ' A' ' 67' ' ' SER . 9.7 mt-30 -127.75 171.56 11.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.906 0.384 . . . . 0.0 110.7 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -68.38 -18.54 64.49 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.238 0.542 . . . . 0.0 110.501 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.1 p -107.54 -170.31 1.68 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.572 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.638 ' CG2' ' H ' ' A' ' 72' ' ' ALA . 3.0 p -81.76 -150.8 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.739 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.638 ' H ' ' CG2' ' A' ' 71' ' ' VAL . . . -122.65 -64.73 1.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.215 0.531 . . . . 0.0 110.988 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.404 ' CB ' ' O ' ' A' ' 72' ' ' ALA . 0.2 OUTLIER 75.99 -70.32 0.14 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.466 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.5 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 6.2 mt-10 -153.75 -63.32 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.504 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.5 ' CD ' ' CB ' ' A' ' 74' ' ' GLU . 17.8 Cg_endo -59.41 -95.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 122.743 2.295 . . . . 0.0 111.991 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.597 ' HG ' ' H ' ' A' ' 77' ' ' GLU . 6.9 t 61.02 -179.86 0.11 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.637 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.597 ' H ' ' HG ' ' A' ' 76' ' ' SER . 29.5 mm-40 -106.07 -37.88 6.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.464 0.649 . . . . 0.0 110.31 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.773 ' CG2' ' H ' ' A' ' 79' ' ' GLU . 8.9 p -152.63 -131.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.74 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.773 ' H ' ' CG2' ' A' ' 78' ' ' VAL . 7.3 mt-10 -60.9 -128.59 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.941 -0.303 . . . . 0.0 110.479 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.543 ' C ' ' HG ' ' A' ' 67' ' ' SER . . . -174.41 10.12 0.03 OUTLIER Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.83 -0.908 . . . . 0.0 110.83 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 90.5 p -76.05 -172.56 2.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.919 0.39 . . . . 0.0 110.641 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.4 137.61 58.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.74 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -105.68 167.13 9.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.183 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.571 ' O ' ' O ' ' A' ' 85' ' ' LYS . 1.5 m-20 -110.67 35.7 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.783 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.571 ' O ' ' O ' ' A' ' 84' ' ' ASN . 2.1 ttmm -52.74 -120.26 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.924 0.392 . . . . 0.0 110.725 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.492 ' H ' ' HG2' ' A' ' 85' ' ' LYS . 14.5 tt0 -64.98 -83.63 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.584 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.43 157.98 34.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.635 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 7.1 tt -70.22 -27.72 64.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.603 0.716 . . . . 0.0 109.509 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 61.02 174.46 0.11 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.324 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.436 ' HG3' ' H ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -127.25 -177.97 4.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.647 -179.775 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.436 ' H ' ' HG3' ' A' ' 90' ' ' LYS . 75.2 t -140.77 69.98 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.403 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.409 HD12 HG22 ' A' ' 92' ' ' ILE . 20.3 pt -81.47 135.26 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.361 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.5 t70 179.63 105.49 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.164 0.506 . . . . 0.0 110.377 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 28.3 mt -142.63 -89.17 0.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.111 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.4 t -121.75 90.09 3.24 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.325 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -86.64 -28.45 23.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.024 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.401 ' O ' ' C ' ' A' ' 98' ' ' ASN . 12.3 t70 -94.2 61.28 2.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.528 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 97' ' ' ASP . 0.2 OUTLIER -38.89 136.89 0.72 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.562 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.44 ' O ' HD12 ' A' ' 102' ' ' LEU . 2.0 pttt -140.18 -86.99 0.2 Allowed 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.469 0.652 . . . . 0.0 110.976 -179.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.485 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 2.3 m-20 -67.92 -25.18 65.35 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.329 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.37 -60.72 3.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.312 -179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.762 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -81.39 -22.52 38.24 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.73 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.505 ' N ' HD23 ' A' ' 102' ' ' LEU . 6.4 mt-30 -66.71 -40.84 88.61 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.677 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.95 -53.22 9.37 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.362 -1.29 . . . . 0.0 111.026 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.68 -51.52 68.43 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.663 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -55.38 -45.01 77.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.938 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.45 ' O ' ' CB ' ' A' ' 111' ' ' LEU . . . -68.89 -31.04 69.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.136 -179.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -28.0 63.27 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.013 0.435 . . . . 0.0 109.854 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.7 -18.66 16.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 106' ' ' ILE . 4.7 tt -97.92 -16.77 19.58 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.571 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.45 ' CB ' ' O ' ' A' ' 107' ' ' ALA . 2.9 tt -101.22 -23.65 14.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.753 -179.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.549 ' O ' ' C ' ' A' ' 113' ' ' SER . 0.3 OUTLIER -121.11 -20.29 6.84 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.764 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.549 ' C ' ' O ' ' A' ' 112' ' ' GLU . 0.9 OUTLIER 22.12 78.74 0.2 Allowed Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.148 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.98 -157.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.774 2.316 . . . . 0.0 112.013 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 6.6 mptt -87.11 -117.43 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.286 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 1.3 mt -142.77 160.1 18.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.388 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.424 ' O ' ' O ' ' A' ' 118' ' ' ALA . 15.2 mt-30 -104.12 42.06 1.23 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.519 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.448 ' O ' ' OD1' ' A' ' 119' ' ' ASP . . . 40.79 -162.52 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.476 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 118' ' ' ALA . 1.0 OUTLIER -162.93 -91.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.59 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.691 0 CA-C-O 117.999 -1.445 . . . . 0.0 111.038 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptt? . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 t -158.96 -171.21 3.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.439 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.17 -149.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.693 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -61.31 -178.2 0.11 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.813 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' A' ' 6' ' ' GLN . 0.6 OUTLIER -90.69 178.56 6.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.434 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.554 ' C ' ' O ' ' A' ' 5' ' ' LEU . 3.5 mt-30 26.83 94.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.574 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -63.26 -120.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.042 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -44.71 -26.54 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.036 0.446 . . . . 0.0 111.151 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.55 -20.77 58.02 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.709 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.83 -121.12 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.771 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.45 89.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.439 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.43 120.53 0.61 Allowed Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.73 158.4 15.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.333 . . . . 0.0 110.507 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . -77.77 -145.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.521 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.48 ' C ' ' O ' ' A' ' 14' ' ' ALA . 89.0 m-20 -32.1 -36.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.526 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . 130.66 -4.21 5.79 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.821 -0.912 . . . . 0.0 110.821 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -107.74 143.39 36.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.801 0.334 . . . . 0.0 110.628 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 159.53 143.3 3.62 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.961 -0.855 . . . . 0.0 110.961 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.9 m -110.95 -59.58 1.95 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.813 0.339 . . . . 0.0 110.613 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.463 ' H ' ' HG ' ' A' ' 20' ' ' SER . 0.5 OUTLIER -46.37 147.07 1.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.611 179.962 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.8 t -118.6 145.49 45.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.64 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.532 ' N ' ' OE1' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -48.01 -22.57 0.62 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.759 -179.857 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 14.7 mtt -69.73 -22.86 63.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.974 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 mp -70.61 -62.88 1.22 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.329 0.585 . . . . 0.0 110.517 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.711 ' CD2' ' H ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -62.84 -35.89 81.43 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.241 179.711 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -62.2 -55.83 24.64 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.215 0.531 . . . . 0.0 110.139 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER -52.56 -60.55 3.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.649 179.263 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.422 ' CD2' HD23 ' A' ' 40' ' ' LEU . 11.1 tp -46.45 -51.86 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.554 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -60.91 -21.29 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.437 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.467 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.3 tt0 -86.43 -24.25 25.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 31.3 mt -87.26 -53.35 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 CA-C-O 121.889 0.852 . . . . 0.0 110.537 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.496 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.7 p -82.63 -37.29 25.16 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.048 -1.433 . . . . 0.0 111.675 -178.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.28 35.34 17.96 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.551 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -99.41 142.42 15.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.893 0.378 . . . . 0.0 110.827 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -112.96 23.35 13.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.46 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.611 ' O ' ' N ' ' A' ' 38' ' ' SER . 15.2 m-20 -112.39 73.94 1.46 Allowed Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.441 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -35.36 -24.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.605 2.203 . . . . 0.0 112.021 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.611 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -71.88 -52.98 14.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.258 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.687 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -70.99 -25.21 62.6 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.766 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.478 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -71.84 -47.84 50.27 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.771 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -65.26 -26.96 68.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.123 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.51 -53.77 42.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.432 ' CB ' ' CD1' ' A' ' 58' ' ' LEU . . . -59.69 -38.37 81.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.261 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.487 ' N ' HD21 ' A' ' 44' ' ' LEU . 3.3 mm? -67.36 -30.12 69.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.934 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -77.26 -33.94 55.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.11 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.474 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -81.86 -37.9 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.749 -179.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 48' ' ' ASN . 32.0 p -67.53 -12.75 61.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.757 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.411 ' CB ' ' O ' ' A' ' 47' ' ' SER . 0.2 OUTLIER 74.03 37.79 0.61 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.83 -23.58 30.25 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -67.71 125.61 26.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.833 0.349 . . . . 0.0 110.281 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.633 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.6 OUTLIER -78.02 -57.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -179.636 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.633 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 18.5 m -45.39 -53.04 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.937 0.399 . . . . 0.0 110.568 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.492 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 44.9 mt-30 -55.69 -55.33 33.47 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.283 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -41.33 -54.04 3.12 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.586 0.708 . . . . 0.0 109.149 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.456 ' HB ' ' O ' ' A' ' 52' ' ' THR . 61.6 t -47.57 -56.96 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.635 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -51.28 -46.67 62.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.306 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.492 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.1 mp -60.2 -34.54 73.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 0.0 111.327 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.503 ' CD2' ' CE2' ' A' ' 39' ' ' PHE . 18.8 mt -81.44 -58.18 3.14 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.428 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.693 ' O ' ' N ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -82.21 5.52 19.59 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.672 -178.797 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.576 ' C ' ' O ' ' A' ' 59' ' ' THR . 0.5 OUTLIER -28.12 -35.51 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.568 0.699 . . . . 0.0 109.54 179.808 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.693 ' N ' ' O ' ' A' ' 59' ' ' THR . 2.5 pm0 -132.76 -39.23 0.98 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.19 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.656 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 1.4 tpt180 174.19 -67.8 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.757 179.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.658 ' N ' ' OE2' ' A' ' 61' ' ' GLU . 0.9 OUTLIER 175.51 -23.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.789 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.471 ' N ' ' CD ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -134.06 -157.02 0.78 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.933 0.397 . . . . 0.0 111.086 -179.84 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.441 ' N ' ' HG2' ' A' ' 64' ' ' LYS . 80.0 mt-10 -105.4 77.24 0.36 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.381 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -64.84 -47.51 4.99 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.139 1.893 . . . . 0.0 112.216 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 m -78.95 108.35 12.36 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.38 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -127.81 144.71 51.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.769 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -90.84 -19.42 23.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.281 0.562 . . . . 0.0 110.518 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.7 p -110.7 132.84 53.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.539 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.642 ' CG2' ' N ' ' A' ' 72' ' ' ALA . 1.5 p -161.64 171.5 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.407 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.642 ' N ' ' CG2' ' A' ' 71' ' ' VAL . . . -77.95 -45.51 23.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.054 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.659 ' OG1' ' N ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -110.5 -159.5 0.68 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.422 -179.494 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.659 ' N ' ' OG1' ' A' ' 73' ' ' THR . 5.7 mm-40 -31.77 130.66 0.29 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.975 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.608 ' O ' ' O ' ' A' ' 74' ' ' GLU . 52.8 Cg_exo -48.27 -151.87 0.0 OUTLIER 'Trans proline' 0 N--CA 1.493 1.488 0 C-N-CA 122.483 2.122 . . . . 0.0 112.348 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.512 ' O ' ' O ' ' A' ' 75' ' ' PRO . 8.5 t -45.62 179.78 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.665 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -68.07 -7.29 28.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.737 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.542 ' CG1' ' H ' ' A' ' 79' ' ' GLU . 19.5 t -153.12 174.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.568 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.542 ' H ' ' CG1' ' A' ' 78' ' ' VAL . 4.7 mm-40 -82.1 -158.11 0.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.622 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -62.86 120.2 20.45 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.21 169.41 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.859 0.361 . . . . 0.0 110.525 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -46.42 134.35 9.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.693 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.578 ' C ' HD21 ' A' ' 84' ' ' ASN . . . -148.25 158.7 44.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.584 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.578 HD21 ' C ' ' A' ' 83' ' ' ALA . 1.6 m-80 -139.87 19.83 2.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.743 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.542 ' C ' ' H ' ' A' ' 87' ' ' VAL . 13.9 tttm -45.81 177.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.31 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.535 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 13.1 tt0 -61.64 2.45 0.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.647 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.542 ' H ' ' C ' ' A' ' 85' ' ' LYS . 2.8 t -124.58 150.4 29.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.171 0.51 . . . . 0.0 110.734 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.481 ' H ' HD13 ' A' ' 88' ' ' LEU . 5.3 mp -81.51 -23.74 37.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.241 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.463 ' H ' HG12 ' A' ' 87' ' ' VAL . . . 56.69 22.65 7.03 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.462 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.556 ' O ' ' CG1' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -147.25 147.27 30.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.146 -179.772 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.556 ' CG1' ' O ' ' A' ' 90' ' ' LYS . 3.2 m -167.95 77.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.279 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.525 ' C ' ' O ' ' A' ' 91' ' ' VAL . 1.2 pt -29.94 129.29 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.597 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.669 ' C ' ' H ' ' A' ' 95' ' ' THR . 18.6 t0 178.03 41.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.146 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.451 ' C ' ' CG2' ' A' ' 95' ' ' THR . 0.2 OUTLIER 70.51 -17.97 0.26 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.577 0.703 . . . . 0.0 109.936 -179.797 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.669 ' H ' ' C ' ' A' ' 93' ' ' ASP . 0.1 OUTLIER 35.89 92.2 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.004 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.498 ' CG ' ' H ' ' A' ' 97' ' ' ASP . 0.4 OUTLIER -68.33 -115.43 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.335 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.498 ' H ' ' CG ' ' A' ' 96' ' ' HIS . 0.2 OUTLIER -94.21 150.23 20.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.466 179.688 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.422 ' N ' ' OD1' ' A' ' 98' ' ' ASN . 1.6 m120 -135.09 144.61 47.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.617 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.519 ' C ' ' H ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -157.76 -12.68 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.498 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.495 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 3.8 p30 -45.1 -17.02 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.843 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.519 ' H ' ' C ' ' A' ' 99' ' ' LYS . 2.0 t70 -63.51 -59.3 4.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.963 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.667 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 4.5 pp -76.25 -32.03 58.66 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.364 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.554 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 0.9 OUTLIER -63.41 -38.49 91.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.724 0.774 . . . . 0.0 109.508 -179.028 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.51 -56.41 4.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.595 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.64 -55.02 29.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.667 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.6 mm -51.89 -52.96 19.72 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.754 179.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.86 73.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.057 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.445 ' C ' ' CD2' ' A' ' 108' ' ' LEU . 8.6 tt -58.18 -32.52 68.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.884 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.06 -18.14 22.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.984 0.421 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.638 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 1.1 tp -88.53 -17.83 29.43 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.71 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.7 tp -82.41 -24.57 34.3 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.138 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.588 ' O ' ' C ' ' A' ' 113' ' ' SER . 1.9 mt-10 -138.54 -96.82 0.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.524 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.588 ' C ' ' O ' ' A' ' 112' ' ' GLU . 1.6 m -13.37 100.02 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.438 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -79.84 -94.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.737 2.292 . . . . 0.0 112.469 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.5 ptpp? -100.82 -170.5 1.86 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.124 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.443 ' C ' ' H ' ' A' ' 118' ' ' ALA . 0.9 OUTLIER -114.89 169.51 5.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.763 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.426 ' H ' HG22 ' A' ' 116' ' ' ILE . 0.3 OUTLIER -78.75 24.58 0.29 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.744 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 116' ' ' ILE . . . -117.84 -179.6 3.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.529 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -149.37 -57.9 0.2 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.754 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.784 0 CA-C-O 118.011 -1.438 . . . . 0.0 110.911 179.946 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mtt . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.7 ' HG1' ' H ' ' A' ' 3' ' ' ALA . 11.7 t -115.24 -163.98 0.92 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.751 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.7 ' H ' ' HG1' ' A' ' 2' ' ' THR . . . -153.25 -140.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.497 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -64.11 158.96 21.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.44 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.69 ' N ' ' CD2' ' A' ' 5' ' ' LEU . 0.0 OUTLIER -106.13 -153.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.927 0.394 . . . . 0.0 110.783 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -139.47 -168.69 2.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.273 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.439 ' HG2' ' N ' ' A' ' 8' ' ' ASP . 38.2 tt0 -130.7 -118.8 0.22 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.463 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.439 ' N ' ' HG2' ' A' ' 7' ' ' GLN . 0.2 OUTLIER -62.88 -18.57 63.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.993 0.425 . . . . 0.0 110.438 179.85 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.454 ' O ' ' C ' ' A' ' 10' ' ' ALA . 49.5 t0 -44.78 -47.48 10.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.716 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.571 ' O ' ' O ' ' A' ' 11' ' ' ALA . . . 33.0 -130.13 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.905 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.571 ' O ' ' O ' ' A' ' 10' ' ' ALA . . . -35.03 163.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.86 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -162.14 153.77 24.54 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -145.87 -127.76 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.816 0.341 . . . . 0.0 110.498 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.547 ' O ' ' O ' ' A' ' 15' ' ' ASP . . . -139.39 128.69 24.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.51 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.547 ' O ' ' O ' ' A' ' 14' ' ' ALA . 8.1 m-20 -36.05 161.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.222 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -109.85 41.46 2.23 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -149.68 24.53 0.87 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.817 0.342 . . . . 0.0 110.473 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -93.69 54.71 2.32 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.453 ' OG ' ' N ' ' A' ' 20' ' ' SER . 4.1 t -104.74 -99.02 0.32 Allowed 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.939 -0.305 . . . . 0.0 110.515 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.453 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.4 OUTLIER 68.11 176.65 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.616 179.875 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.631 ' O ' ' CD2' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -127.59 167.6 16.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.817 -179.719 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -81.76 -13.43 57.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.02 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 28.7 mtt -54.17 -32.07 54.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.846 0.355 . . . . 0.0 111.484 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.631 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -68.7 -60.93 2.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.685 -179.115 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.463 ' N ' HD11 ' A' ' 24' ' ' LEU . 1.8 pp -62.76 -38.93 92.52 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.948 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.425 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -63.81 -58.32 7.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.236 0.541 . . . . 0.0 110.757 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -53.49 -59.02 5.13 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.948 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.446 ' H ' HD13 ' A' ' 51' ' ' ILE . 6.6 tp -52.88 -57.93 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.908 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -59.4 -21.52 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.29 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.2 -35.01 25.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.826 0.346 . . . . 0.0 110.769 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.6 mt -73.0 -52.41 22.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-O 121.659 0.743 . . . . 0.0 110.684 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.477 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.0 p -79.74 -35.32 39.02 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.609 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 67.28 36.15 89.11 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.568 HG23 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -89.32 155.71 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.256 -0.472 . . . . 0.0 111.705 -178.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -122.26 23.35 9.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.608 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.669 ' O ' ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -119.77 70.09 13.41 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -34.83 -20.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.962 2.441 . . . . 0.0 112.221 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.669 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -73.73 -52.43 13.23 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.632 179.66 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.699 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -69.33 -25.38 64.18 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.514 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mt -69.61 -59.79 2.74 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.723 ' ND1' ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -57.51 -27.57 62.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.447 179.136 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.723 ' N ' ' ND1' ' A' ' 41' ' ' HIS . 62.9 tt0 -61.3 -56.77 16.74 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.67 179.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.435 ' HB2' ' CD2' ' A' ' 58' ' ' LEU . . . -58.56 -38.7 78.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.503 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.0 mm? -67.59 -24.9 65.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.96 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.43 -30.59 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.179 179.237 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.431 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -82.07 -36.95 27.12 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.813 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.666 ' HG ' ' CB ' ' A' ' 50' ' ' ASP . 41.4 t -72.58 -16.24 61.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 73.6 36.38 0.78 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.956 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.66 -23.69 35.13 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.666 ' CB ' ' HG ' ' A' ' 47' ' ' SER . 0.4 OUTLIER -66.97 116.08 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.6 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.7 tt -70.15 -50.88 43.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.408 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.6 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 54.4 m -50.87 -61.44 2.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.289 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.474 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 0.7 OUTLIER -49.85 -56.24 11.19 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.887 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.05 -55.18 2.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.459 ' O ' ' CG2' ' A' ' 59' ' ' THR . 21.4 t -47.24 -58.57 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.746 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.6 t -48.47 -50.08 32.97 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.474 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 5.0 mp -55.4 -36.78 66.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.196 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.666 ' O ' ' CG ' ' A' ' 62' ' ' ARG . 25.5 mt -80.5 -62.21 1.74 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.941 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.55 ' O ' ' C ' ' A' ' 60' ' ' ASP . 0.1 OUTLIER -71.77 -2.14 16.51 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.542 -178.33 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.55 ' C ' ' O ' ' A' ' 59' ' ' THR . 19.2 t0 -26.39 -50.78 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.913 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 179.91 49.14 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.114 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.666 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -132.29 -101.89 0.27 Allowed 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.133 0.492 . . . . 0.0 110.467 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.65 ' CG2' ' H ' ' A' ' 64' ' ' LYS . 12.9 m -61.83 -66.14 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.406 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.65 ' H ' ' CG2' ' A' ' 63' ' ' VAL . 2.1 pttp 31.73 -158.89 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.874 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.481 ' N ' ' HD3' ' A' ' 66' ' ' PRO . 0.8 OUTLIER 168.65 59.42 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.786 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.481 ' HD3' ' N ' ' A' ' 65' ' ' GLU . 94.3 Cg_endo -85.21 -155.46 0.06 OUTLIER 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.983 2.455 . . . . 0.0 112.466 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 m -121.69 99.76 6.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.207 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -122.96 -22.81 5.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.115 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.587 ' O ' ' O ' ' A' ' 70' ' ' THR . 3.4 t0 -79.45 -23.21 43.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.047 0.451 . . . . 0.0 110.985 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.587 ' O ' ' O ' ' A' ' 69' ' ' ASP . 7.8 p 52.2 130.89 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.768 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.643 ' CG2' ' N ' ' A' ' 72' ' ' ALA . 0.3 OUTLIER -161.2 164.95 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.348 0.594 . . . . 0.0 110.985 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.643 ' N ' ' CG2' ' A' ' 71' ' ' VAL . . . -55.82 -99.55 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.134 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.457 HG22 ' H ' ' A' ' 74' ' ' GLU . 3.7 m -52.22 178.6 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.453 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.457 ' H ' HG22 ' A' ' 73' ' ' THR . 21.0 tp10 63.23 80.27 0.25 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.319 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -45.66 160.75 0.15 Allowed 'Trans proline' 0 C--N 1.305 -1.75 0 C-N-CA 122.787 2.324 . . . . 0.0 111.864 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.418 ' H ' ' HG ' ' A' ' 76' ' ' SER . 0.7 OUTLIER -73.44 155.68 39.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.5 -179.897 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -68.64 -6.29 25.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.558 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.736 ' CG1' ' H ' ' A' ' 79' ' ' GLU . 3.9 t -134.1 -147.73 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.82 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.736 ' H ' ' CG1' ' A' ' 78' ' ' VAL . 1.5 pt-20 -126.37 -154.51 0.63 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.617 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.06 61.65 1.56 Allowed Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.581 ' O ' ' O ' ' A' ' 82' ' ' ALA . 97.9 p -119.89 -170.19 1.91 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.787 0.327 . . . . 0.0 110.642 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.581 ' O ' ' O ' ' A' ' 81' ' ' SER . . . -48.97 -167.62 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.53 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -138.54 -166.03 1.92 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.56 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -152.28 -6.06 0.22 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.244 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -42.92 164.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.444 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -179.53 79.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.459 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -146.49 131.7 12.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.768 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.93 -27.9 67.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.302 0.573 . . . . 0.0 110.207 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 60.83 -87.52 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.353 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.03 -169.12 0.08 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.646 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.742 ' CG1' ' H ' ' A' ' 92' ' ' ILE . 4.2 p -95.69 -99.06 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.675 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.742 ' H ' ' CG1' ' A' ' 91' ' ' VAL . 1.9 pt -142.33 179.6 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.421 ' CB ' ' O ' ' A' ' 92' ' ' ILE . 16.7 t0 75.53 90.87 0.08 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.028 0.442 . . . . 0.0 110.393 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.762 ' CD2' ' H ' ' A' ' 95' ' ' THR . 0.4 OUTLIER -109.99 -49.24 3.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.559 0.695 . . . . 0.0 110.357 -179.657 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.762 ' H ' ' CD2' ' A' ' 94' ' ' LEU . 30.9 m -162.62 65.22 0.21 Allowed 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.643 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.412 ' CG ' ' O ' ' A' ' 95' ' ' THR . 14.2 m-70 -166.84 159.01 13.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.734 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 176.21 81.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.365 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.691 ' O ' ' N ' ' A' ' 101' ' ' ASP . 8.5 m-20 -128.96 -25.97 2.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.159 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.614 ' O ' ' CD2' ' A' ' 102' ' ' LEU . 3.3 ptpp? 19.06 -95.28 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.004 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -40.34 63.58 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.335 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.691 ' N ' ' O ' ' A' ' 98' ' ' ASN . 0.3 OUTLIER -52.87 -59.42 4.53 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.675 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -77.18 -34.76 56.25 Favored 'General case' 0 C--O 1.21 -0.976 0 C-N-CA 120.304 -0.559 . . . . 0.0 112.425 -178.441 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.556 ' N ' ' CD2' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -63.22 -35.66 81.08 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.806 0.812 . . . . 0.0 109.561 -178.766 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.68 -56.57 4.2 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.442 -1.253 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.62 -47.7 73.12 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.518 0.675 . . . . 0.0 109.289 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.675 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.8 mm -61.08 -46.72 96.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.612 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.771 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.39 -45.7 92.62 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.85 -179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.3 tp -59.62 -43.33 93.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.647 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.0 -19.17 34.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.245 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.517 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.3 tm? -87.55 -15.87 36.21 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.77 -28.3 68.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.519 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.483 ' O ' ' O ' ' A' ' 113' ' ' SER . 4.0 mm-40 -115.35 -102.11 0.42 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.156 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.483 ' O ' ' O ' ' A' ' 112' ' ' GLU . 0.0 OUTLIER -39.65 165.22 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.502 179.854 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -75.18 -168.68 0.54 Allowed 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.863 2.376 . . . . 0.0 112.372 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.23 -149.98 0.46 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.395 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 1.1 mt -102.03 170.01 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.391 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -106.0 70.37 0.85 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.678 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -77.12 -139.99 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.516 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.45 -105.96 0.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.57 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.777 0 CA-C-O 117.994 -1.448 . . . . 0.0 110.849 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttm . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.63 102.76 14.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.648 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -115.36 -174.43 2.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.286 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.422 ' HB3' ' H ' ' A' ' 5' ' ' LEU . 1.1 tp10 69.61 -83.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.502 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.646 ' H ' ' CD1' ' A' ' 5' ' ' LEU . 0.0 OUTLIER -80.06 -174.34 4.42 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.515 179.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.629 ' NE2' ' O ' ' A' ' 5' ' ' LEU . 0.0 OUTLIER -138.48 175.96 9.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.908 0.385 . . . . 0.0 110.663 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.556 ' O ' ' N ' ' A' ' 10' ' ' ALA . 3.1 mp0 -100.26 -88.39 0.35 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.439 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -43.53 -21.56 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.778 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.44 ' N ' ' C ' ' A' ' 7' ' ' GLN . 0.7 OUTLIER -90.71 -28.91 18.01 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.698 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.556 ' N ' ' O ' ' A' ' 7' ' ' GLN . . . -111.17 130.41 55.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.38 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.77 177.77 4.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.651 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 47.09 -113.62 1.3 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -130.83 171.63 12.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.765 0.317 . . . . 0.0 110.433 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.49 159.99 22.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.541 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -167.25 1.46 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.342 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -106.95 99.53 1.45 Allowed Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.684 ' ND1' ' N ' ' A' ' 18' ' ' GLY . 4.9 p80 -47.53 -33.0 5.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.729 0.3 . . . . 0.0 110.651 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.684 ' N ' ' ND1' ' A' ' 17' ' ' HIS . . . 179.01 -164.09 32.14 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' A' ' 20' ' ' SER . 4.9 p -118.2 -139.24 0.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.788 0.328 . . . . 0.0 110.499 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.597 ' N ' ' OG ' ' A' ' 19' ' ' SER . 10.8 t -156.65 137.93 13.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.701 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.5 167.88 9.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.47 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.624 ' O ' ' CD1' ' A' ' 25' ' ' LEU . 9.1 mt-30 -80.0 -18.44 50.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.372 0.606 . . . . 0.0 110.245 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.602 ' N ' ' SD ' ' A' ' 23' ' ' MET . 0.1 OUTLIER -70.96 -19.19 62.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.572 -179.868 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.684 ' O ' ' CD2' ' A' ' 28' ' ' LEU . 10.0 mp -68.54 -65.84 0.65 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.469 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.625 ' CD2' ' C ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -65.64 -33.92 77.01 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.587 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.609 ' O ' ' CG ' ' A' ' 30' ' ' GLU . 6.3 t-20 -64.57 -40.95 96.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.173 0.511 . . . . 0.0 109.986 178.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 23' ' ' MET . 10.3 mm100 -65.59 -63.66 1.04 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.6 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.684 ' CD2' ' O ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -51.33 -48.72 62.33 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 119.807 -0.757 . . . . 0.0 110.479 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.75 -22.35 65.23 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.141 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.609 ' CG ' ' O ' ' A' ' 26' ' ' ASN . 15.2 mm-40 -85.86 -20.86 28.48 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.981 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.414 HD11 HG22 ' A' ' 31' ' ' ILE . 94.1 mt -94.49 -38.8 9.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-O 121.6 0.714 . . . . 0.0 110.927 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.454 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 11.4 p -94.89 -35.39 12.05 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.794 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.74 36.0 58.39 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.565 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -93.72 152.22 3.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.246 -0.477 . . . . 0.0 111.237 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -120.73 23.59 10.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.035 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.628 ' O ' ' N ' ' A' ' 38' ' ' SER . 10.2 t70 -120.16 74.24 21.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.5 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -37.28 -20.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.666 2.244 . . . . 0.0 111.683 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.633 ' O ' ' ND1' ' A' ' 41' ' ' HIS . 0.7 OUTLIER -69.95 -54.0 15.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.549 -179.449 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.666 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -74.42 -26.39 60.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 10.6 mt -63.08 -46.88 85.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.633 ' ND1' ' O ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -67.57 -36.42 80.89 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.796 179.174 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.571 ' N ' ' CD2' ' A' ' 41' ' ' HIS . 4.9 tt0 -51.89 -49.12 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.551 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.429 ' HB2' ' CD2' ' A' ' 58' ' ' LEU . . . -69.29 -56.83 6.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.564 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.552 ' N ' HD21 ' A' ' 44' ' ' LEU . 4.1 mm? -45.33 -25.79 0.44 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.407 ' N ' ' C ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -83.78 -49.38 9.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.347 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 48' ' ' ASN . . . -64.12 -41.98 97.02 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.75 0.309 . . . . 0.0 110.968 -179.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.496 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 6.8 p -68.09 4.65 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.809 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.464 ' H ' ' C ' ' A' ' 46' ' ' ALA . 3.2 m-80 56.48 33.22 22.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.7 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.79 -23.6 35.27 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.496 ' O ' ' OG ' ' A' ' 47' ' ' SER . 11.7 m-20 -62.45 106.13 0.72 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.556 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -63.78 -58.4 7.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.691 -179.379 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.556 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.1 m -43.89 -46.19 7.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.122 0.487 . . . . 0.0 110.336 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.635 ' OE1' ' N ' ' A' ' 53' ' ' GLN . 1.8 mp0 -64.74 -53.54 45.53 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -42.02 -54.02 3.68 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.468 ' O ' ' CG2' ' A' ' 59' ' ' THR . 69.1 t -46.72 -58.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.126 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -48.86 -46.98 43.13 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.98 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.476 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 5.9 mp -62.27 -34.3 76.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.132 0.491 . . . . 0.0 111.413 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.473 HD23 ' CE2' ' A' ' 39' ' ' PHE . 18.9 mt -87.89 -14.1 40.26 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -177.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.672 ' C ' ' H ' ' A' ' 61' ' ' GLU . 1.4 t -132.82 13.06 4.39 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 119.523 -0.871 . . . . 0.0 112.887 -179.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.634 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 7.5 t70 -64.29 14.13 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.106 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.672 ' H ' ' C ' ' A' ' 59' ' ' THR . 14.8 tt0 93.59 63.48 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.062 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.536 ' O ' ' C ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER -146.66 -60.68 0.3 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.019 -178.49 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.602 ' O ' ' O ' ' A' ' 64' ' ' LYS . 2.3 t -25.09 -71.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.67 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.602 ' O ' ' O ' ' A' ' 63' ' ' VAL . 0.1 OUTLIER 39.79 -172.59 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.109 -179.579 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.483 ' C ' ' O ' ' A' ' 64' ' ' LYS . 27.9 mt-10 -33.57 94.9 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.424 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.498 ' N ' ' O ' ' A' ' 64' ' ' LYS . 16.9 Cg_exo -63.5 -151.69 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.55 0 C-N-CA 122.579 2.186 . . . . 0.0 112.611 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.559 ' O ' ' OG ' ' A' ' 67' ' ' SER . 2.9 p 55.6 64.41 1.76 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.143 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.474 ' HG3' ' N ' ' A' ' 69' ' ' ASP . 1.6 pp0? -129.1 -30.48 2.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.817 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.474 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 3.3 t0 -94.26 -20.25 19.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.162 0.506 . . . . 0.0 110.827 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.576 ' O ' ' O ' ' A' ' 71' ' ' VAL . 30.1 p -96.59 150.95 20.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.446 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.605 ' O ' ' O ' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -32.15 155.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.405 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.605 ' O ' ' O ' ' A' ' 71' ' ' VAL . . . -37.27 -107.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.24 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.48 ' CB ' ' O ' ' A' ' 72' ' ' ALA . 0.2 OUTLIER 78.47 -172.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.161 -179.404 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.501 ' H ' ' HD2' ' A' ' 75' ' ' PRO . 2.1 mt-10 -116.45 -53.33 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.308 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.028 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.501 ' HD2' ' H ' ' A' ' 74' ' ' GLU . 84.1 Cg_endo -87.46 -105.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 122.9 2.4 . . . . 0.0 112.142 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.427 ' HG ' ' H ' ' A' ' 77' ' ' GLU . 1.6 t -142.0 178.6 7.41 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.385 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.445 ' OE1' ' OD1' ' A' ' 36' ' ' ASP . 12.4 mt-10 -41.48 -83.44 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.728 0.775 . . . . 0.0 110.407 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.78 ' CG2' ' H ' ' A' ' 79' ' ' GLU . 9.9 p -81.57 -150.67 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.45 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.78 ' H ' ' CG2' ' A' ' 78' ' ' VAL . 0.7 OUTLIER -86.48 154.62 20.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.424 179.837 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 128.74 141.71 5.22 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 82' ' ' ALA . 31.6 m -145.78 -176.57 5.19 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.585 ' O ' ' O ' ' A' ' 81' ' ' SER . . . -53.39 -148.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -46.24 157.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.408 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -86.29 22.29 1.84 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.277 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 86' ' ' GLU . 1.9 pttt -129.03 166.65 18.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.614 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 27.7 tt0 176.71 31.8 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.998 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.477 HG13 ' H ' ' A' ' 88' ' ' LEU . 13.5 t -151.0 154.95 7.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.567 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.563 ' O ' ' O ' ' A' ' 89' ' ' ALA . 4.0 mp -107.75 -25.45 11.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.603 179.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.563 ' O ' ' O ' ' A' ' 88' ' ' LEU . . . 50.09 118.11 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.969 179.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.528 ' O ' ' CG2' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -150.83 155.79 39.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.205 -179.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.528 ' CG2' ' O ' ' A' ' 90' ' ' LYS . 72.3 t -161.17 83.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.396 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -87.41 138.09 19.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.47 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -177.78 111.44 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.567 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.661 ' O ' ' NE2' ' A' ' 96' ' ' HIS . 1.6 pt? -131.66 -48.41 0.97 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.449 0.642 . . . . 0.0 110.934 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.568 ' N ' ' HG ' ' A' ' 94' ' ' LEU . 10.5 t -66.77 139.9 57.82 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.794 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.661 ' NE2' ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER 174.32 -176.39 0.08 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.426 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 43.87 89.14 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.841 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.463 HD21 HE22 ' A' ' 103' ' ' GLN . 11.7 p-10 -97.94 148.94 22.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.187 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 103' ' ' GLN . 3.1 tppt? -141.65 148.92 39.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.235 0.541 . . . . 0.0 111.278 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.422 ' O ' ' CB ' ' A' ' 104' ' ' ALA . 1.9 p30 -59.47 -14.76 13.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.214 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.92 -62.7 1.67 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.925 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.754 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.77 -20.56 30.83 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.845 179.027 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.487 ' N ' HD22 ' A' ' 102' ' ' LEU . 3.2 mt-30 -68.34 -35.63 78.05 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.422 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -81.06 -49.66 10.61 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.352 -1.295 . . . . 0.0 110.61 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.92 -42.27 97.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.674 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.0 mm -65.07 -50.04 76.45 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.792 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.08 -47.92 84.1 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.9 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.43 -43.69 88.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.771 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -18.94 38.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.175 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 2.4 tt -87.07 -16.04 36.76 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.424 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.5 mp -75.84 -19.59 58.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.482 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -118.17 -19.57 8.97 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.778 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.55 162.62 0.12 Allowed Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.697 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -43.02 168.16 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.924 2.416 . . . . 0.0 112.547 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.94 -73.13 0.43 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.433 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.697 ' CG2' ' H ' ' A' ' 117' ' ' GLN . 55.2 mt -116.85 -117.27 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.525 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.697 ' H ' ' CG2' ' A' ' 116' ' ' ILE . 0.9 OUTLIER -110.17 31.43 5.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.472 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -75.46 -96.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.618 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.24 -35.72 80.15 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.37 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.788 0 CA-C-O 118.009 -1.439 . . . . 0.0 110.966 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.09 -159.52 1.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.522 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.546 ' O ' ' N ' ' A' ' 5' ' ' LEU . . . -115.75 -57.96 2.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.191 0.519 . . . . 0.0 110.577 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.468 ' C ' ' O ' ' A' ' 3' ' ' ALA . 0.9 OUTLIER -33.37 -33.63 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.372 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.546 ' N ' ' O ' ' A' ' 3' ' ' ALA . 0.2 OUTLIER -112.12 -178.64 3.47 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.365 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.61 ' N ' ' CD ' ' A' ' 6' ' ' GLN . 13.1 mp0 -81.62 149.61 28.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.918 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -112.8 -5.27 13.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.371 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 9' ' ' ASP . 1.1 m-20 -100.1 -21.29 15.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.322 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.435 ' C ' ' O ' ' A' ' 8' ' ' ASP . 7.9 t70 -36.65 -63.89 0.38 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.42 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.52 -168.84 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.331 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -158.76 -161.7 1.0 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.814 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.87 -82.31 0.66 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.81 -33.61 24.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.318 0.58 . . . . 0.0 110.562 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 42.83 -148.33 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.456 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -120.61 -86.62 0.65 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.58 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -94.14 -1.11 65.13 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -86.35 114.76 23.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.814 0.34 . . . . 0.0 110.631 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -79.33 -147.22 3.96 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.6 m -138.77 122.36 17.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.89 0.376 . . . . 0.0 110.656 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.2 t -178.36 147.11 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.428 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.88 134.75 36.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.611 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.71 -14.74 59.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.474 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.1 mtm -67.31 -23.84 65.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.518 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.0 mt -66.78 -63.8 0.99 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.982 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -34.9 79.46 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.951 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.418 ' C ' HD21 ' A' ' 26' ' ' ASN . 0.6 OUTLIER -61.88 -53.36 56.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.085 0.469 . . . . 0.0 110.241 179.582 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' GLU . 12.3 mm-40 -55.99 -60.19 3.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.548 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.422 HD22 ' CD1' ' A' ' 44' ' ' LEU . 15.9 tp -45.42 -49.84 12.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.407 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 1.1 tmt_? -63.27 -20.57 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.161 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 27' ' ' GLN . 4.8 tp10 -84.39 -22.07 30.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.127 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.7 mt -92.5 -52.98 9.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.727 0.775 . . . . 0.0 110.72 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.424 ' OG1' HG13 ' A' ' 34' ' ' ILE . 9.7 p -81.76 -36.8 28.12 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.378 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 29' ' ' ARG . . . 79.14 35.78 29.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.549 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -98.57 140.66 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.989 0.423 . . . . 0.0 111.201 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -112.06 22.64 14.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.318 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.549 ' H ' HG21 ' A' ' 34' ' ' ILE . 4.4 t70 -110.67 74.44 0.92 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.979 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -35.88 -25.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.723 2.282 . . . . 0.0 112.393 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -68.9 -53.11 22.94 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.683 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -73.17 -24.97 60.62 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.154 0.502 . . . . 0.0 109.652 -179.794 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.493 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -69.67 -51.43 34.74 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.625 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -24.97 63.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.94 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -68.31 -39.16 82.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.47 ' CB ' ' CD1' ' A' ' 58' ' ' LEU . . . -68.93 -55.68 10.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.446 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.455 ' N ' HD12 ' A' ' 44' ' ' LEU . 7.5 mp -53.86 -36.75 62.95 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.25 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -53.99 37.15 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.56 -24.89 50.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.74 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.58 -7.65 49.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 65.88 39.01 4.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.811 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.53 -23.39 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.517 ' C ' ' OD1' ' A' ' 50' ' ' ASP . 16.4 t0 -64.17 93.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.651 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.5 tt -50.59 -57.87 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.143 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.651 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 38.6 m -42.07 -53.46 3.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.98 0.419 . . . . 0.0 110.28 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.505 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 2.2 mt-30 -57.04 -53.89 52.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.209 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -40.38 -57.3 1.81 Allowed 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.425 ' HB ' ' O ' ' A' ' 52' ' ' THR . 40.3 t -46.62 -60.75 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.856 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -42.39 -49.71 5.17 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.741 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.505 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.3 mp -60.43 -36.66 78.7 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.696 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.526 ' CD2' ' CE2' ' A' ' 39' ' ' PHE . 11.5 mt -90.84 -11.01 40.61 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.171 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.571 ' C ' ' H ' ' A' ' 61' ' ' GLU . 82.2 p -107.74 -6.33 16.87 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.624 -179.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.572 ' C ' ' HE ' ' A' ' 62' ' ' ARG . 0.5 OUTLIER -66.19 38.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.104 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.676 ' C ' ' HE ' ' A' ' 62' ' ' ARG . 26.1 tt0 69.32 75.88 0.23 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.384 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.676 ' HE ' ' C ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -131.07 -97.38 0.34 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.766 179.862 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.93 -38.52 78.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.304 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.0 tptm 72.36 -178.81 0.21 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.032 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -121.14 90.22 47.09 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.836 0.35 . . . . 0.0 110.907 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.567 ' O ' ' O ' ' A' ' 67' ' ' SER . 73.0 Cg_endo -84.37 -155.96 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 123.13 2.553 . . . . 0.0 112.149 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.567 ' O ' ' O ' ' A' ' 66' ' ' PRO . 4.3 p 31.51 -156.69 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.84 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -140.78 -149.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.576 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.612 ' O ' ' O ' ' A' ' 70' ' ' THR . 4.1 m-20 -111.9 -19.21 12.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.979 0.418 . . . . 0.0 110.733 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.612 ' O ' ' O ' ' A' ' 69' ' ' ASP . 64.4 p -15.44 -109.98 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.607 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.436 ' N ' ' OG1' ' A' ' 70' ' ' THR . 7.0 m -140.84 -169.07 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.676 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.543 ' O ' ' C ' ' A' ' 73' ' ' THR . . . -106.04 -31.54 8.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.388 0.613 . . . . 0.0 109.801 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.543 ' C ' ' O ' ' A' ' 72' ' ' ALA . 89.4 m -24.55 -78.2 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.631 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.472 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.6 OUTLIER -127.6 145.19 53.81 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.316 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -69.48 150.42 69.92 Favored 'Trans proline' 0 C--N 1.306 -1.661 0 C-N-CA 122.649 2.233 . . . . 0.0 112.207 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.612 ' O ' ' N ' ' A' ' 78' ' ' VAL . 33.8 t -146.0 34.43 1.01 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.756 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' A' ' 76' ' ' SER . 38.7 mt-10 -32.37 -31.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.11 0.481 . . . . 0.0 110.782 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.781 ' CG1' ' H ' ' A' ' 79' ' ' GLU . 2.6 p -151.91 -91.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.232 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.781 ' H ' ' CG1' ' A' ' 78' ' ' VAL . 59.1 mt-10 -21.48 144.28 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.344 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -169.6 158.37 30.61 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.9 p -116.23 177.43 4.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.929 0.395 . . . . 0.0 110.97 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.38 -111.95 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.001 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.652 ' C ' ' H ' ' A' ' 85' ' ' LYS . . . -147.52 -164.45 2.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.589 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.83 4.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.48 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.652 ' H ' ' C ' ' A' ' 83' ' ' ALA . 8.9 mtpt -72.36 170.91 13.19 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.93 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.578 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 15.3 tt0 -119.66 1.45 11.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.096 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.632 ' CG1' ' H ' ' A' ' 88' ' ' LEU . 4.5 t -123.45 -174.74 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.496 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.632 ' H ' ' CG1' ' A' ' 87' ' ' VAL . 30.0 tp -110.25 -30.79 7.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.557 0.694 . . . . 0.0 110.004 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.484 ' CB ' ' O ' ' A' ' 88' ' ' LEU . . . 80.21 169.43 0.16 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.551 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.518 ' CB ' ' HZ1' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -99.09 121.09 40.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 111.028 -179.576 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.485 ' O ' ' C ' ' A' ' 92' ' ' ILE . 2.3 p -176.45 27.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.749 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.485 ' C ' ' O ' ' A' ' 91' ' ' VAL . 0.5 OUTLIER -34.38 139.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.341 179.783 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.08 90.91 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.289 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.97 -90.46 0.26 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.555 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.705 ' HG1' ' H ' ' A' ' 96' ' ' HIS . 10.0 t -149.63 -138.34 0.09 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.702 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.705 ' H ' ' HG1' ' A' ' 95' ' ' THR . 0.1 OUTLIER -48.9 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.357 179.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.464 ' O ' ' OD1' ' A' ' 98' ' ' ASN . 4.7 m-20 -146.54 69.59 1.19 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.481 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.478 ' O ' ' CB ' ' A' ' 99' ' ' LYS . 36.6 m-20 -141.61 145.27 34.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.867 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.568 ' CG ' ' H ' ' A' ' 100' ' ' ASP . 0.8 OUTLIER 80.51 -143.67 0.01 OUTLIER 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.341 0.591 . . . . 0.0 112.098 178.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.568 ' H ' ' CG ' ' A' ' 99' ' ' LYS . 0.9 OUTLIER -70.81 -21.77 62.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.015 -179.175 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -55.47 -60.57 3.23 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.834 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.701 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -83.5 -24.83 31.55 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.069 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.538 ' H ' HD12 ' A' ' 102' ' ' LEU . 1.8 mt-30 -68.08 -39.89 82.82 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 118.992 -1.083 . . . . 0.0 109.3 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -51.57 9.03 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.744 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.14 78.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 5.4 mm -61.55 -57.98 9.62 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.788 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -51.85 -44.68 63.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 110.921 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.5 tp -59.3 -40.96 87.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.715 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.04 -17.13 36.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.413 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.65 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -89.96 -16.57 29.63 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.687 -179.401 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.66 -24.27 23.96 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.642 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.91 -18.8 49.66 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.888 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.574 ' O ' ' OG ' ' A' ' 113' ' ' SER . 2.0 t 51.0 48.09 5.49 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.251 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 113' ' ' SER . 68.4 Cg_endo -75.09 -170.32 0.77 Allowed 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.844 2.363 . . . . 0.0 112.447 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 8.6 ptmt -112.79 -172.74 2.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.072 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.645 ' CG2' ' H ' ' A' ' 117' ' ' GLN . 49.0 mt -106.3 -121.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.524 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.645 ' H ' ' CG2' ' A' ' 116' ' ' ILE . 4.0 tt0 -128.92 20.56 5.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.377 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 40.49 -117.73 0.31 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.549 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -123.21 -92.29 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.523 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.735 0 CA-C-O 118.024 -1.431 . . . . 0.0 110.887 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 mtp . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.03 164.22 24.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.473 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.581 ' O ' ' C ' ' A' ' 4' ' ' GLU . . . -132.47 -113.81 0.23 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.829 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.581 ' C ' ' O ' ' A' ' 3' ' ' ALA . 0.4 OUTLIER 4.04 -83.27 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.71 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.677 ' CD2' ' H ' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -59.22 -114.12 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.544 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -99.32 -171.51 2.09 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.523 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -124.06 -111.74 0.31 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.034 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -76.75 -22.14 54.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.263 0.554 . . . . 0.0 110.112 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -38.82 -76.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.833 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -145.81 -179.03 6.42 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.677 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -144.76 161.93 38.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.447 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.539 ' O ' ' C ' ' A' ' 13' ' ' ALA . . . 156.31 -132.26 3.26 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.539 ' C ' ' O ' ' A' ' 12' ' ' GLY . . . 27.86 -145.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.705 0.288 . . . . 0.0 110.607 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -97.05 -178.12 4.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.63 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -118.76 -65.3 1.19 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.475 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.06 -79.48 0.18 Allowed Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.477 ' C ' ' H ' ' A' ' 19' ' ' SER . 8.9 t-160 59.34 56.46 3.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.794 0.331 . . . . 0.0 110.657 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.84 -18.59 2.35 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' A' ' 20' ' ' SER . 3.5 p 40.83 -145.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.844 0.354 . . . . 0.0 110.71 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.531 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.6 OUTLIER -84.17 -170.14 2.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.63 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.47 101.26 13.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.366 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.446 ' O ' ' CB ' ' A' ' 26' ' ' ASN . 1.6 tt0 -81.87 -12.91 58.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.074 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 5.2 mtt -63.34 -49.34 74.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.223 0.535 . . . . 0.0 111.425 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.402 ' N ' ' CD2' ' A' ' 24' ' ' LEU . 4.6 mm? -58.11 -61.44 2.55 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.258 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.481 HD22 ' H ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -58.7 -48.92 79.48 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.436 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.446 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 4.8 t-20 -53.42 -55.25 26.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.22 0.533 . . . . 0.0 110.399 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -56.7 -56.55 19.97 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.158 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.442 HD23 ' CD2' ' A' ' 44' ' ' LEU . 40.8 tp -47.77 -55.99 8.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.696 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -62.1 -25.99 68.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.897 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 29' ' ' ARG . 10.4 mt-10 -76.54 -27.29 55.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.026 0.441 . . . . 0.0 110.375 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 54.4 mt -85.1 -43.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.787 0.803 . . . . 0.0 110.618 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.531 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 7.7 p -90.6 -34.73 15.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.469 -178.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 81.71 35.36 22.5 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.547 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -94.95 148.47 5.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.895 0.379 . . . . 0.0 111.007 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -117.83 23.25 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.212 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.632 ' O ' ' N ' ' A' ' 38' ' ' SER . 17.2 m-20 -119.45 72.83 14.74 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.637 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -36.37 -20.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.79 2.326 . . . . 0.0 112.036 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -72.51 -53.76 11.15 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.728 -1.123 . . . . 0.0 111.387 -179.245 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.673 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -71.13 -28.41 64.27 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.609 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 8.5 mt -62.35 -51.97 65.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -59.69 -33.98 72.27 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.721 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -56.32 -47.76 78.08 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.406 ' CB ' HD11 ' A' ' 58' ' ' LEU . . . -63.83 -54.24 38.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.732 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.442 ' CD2' HD23 ' A' ' 28' ' ' LEU . 4.3 mm? -46.89 -37.36 8.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.866 0.365 . . . . 0.0 110.325 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -80.79 -28.53 36.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.323 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.449 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -77.31 -21.62 53.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.118 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.504 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 59.7 p -101.02 17.78 21.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.77 0.319 . . . . 0.0 110.987 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.504 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.1 OUTLIER 48.89 32.16 3.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.151 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.08 -24.29 31.69 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.522 ' OD2' ' NE2' ' A' ' 53' ' ' GLN . 25.4 m-20 -65.57 99.7 0.45 Allowed 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.386 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.619 ' CG2' ' N ' ' A' ' 52' ' ' THR . 15.1 tt -57.58 -56.73 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.864 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.619 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 55.4 m -43.55 -60.13 1.88 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.021 0.438 . . . . 0.0 110.071 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.522 ' NE2' ' OD2' ' A' ' 50' ' ' ASP . 27.2 mt-30 -50.13 -57.98 6.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.635 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -38.48 -58.39 1.03 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.476 ' O ' ' CG2' ' A' ' 59' ' ' THR . 11.0 t -42.69 -57.46 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.091 0 CA-C-N 115.29 -0.868 . . . . 0.0 108.722 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.456 ' N ' ' O ' ' A' ' 53' ' ' GLN . 6.8 t -48.47 -47.32 38.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.359 -1.291 . . . . 0.0 110.919 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.472 HD11 ' O ' ' A' ' 53' ' ' GLN . 4.2 mp -59.65 -36.34 76.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.092 0.472 . . . . 0.0 110.988 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 54' ' ' ALA . 27.5 mt -81.18 -22.65 38.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.797 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.697 ' C ' ' H ' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -114.7 8.43 16.19 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.19 -178.655 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.646 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 11.0 t0 -58.35 15.79 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.469 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.697 ' H ' ' C ' ' A' ' 59' ' ' THR . 2.0 tp10 97.43 58.48 0.0 OUTLIER 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.829 0.347 . . . . 0.0 111.034 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -133.47 -84.2 0.45 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.162 0.506 . . . . 0.0 110.693 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.578 ' O ' ' O ' ' A' ' 64' ' ' LYS . 35.6 t -51.21 -85.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.204 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.657 ' NZ ' ' OG1' ' A' ' 59' ' ' THR . 9.7 mtpp 17.59 -138.47 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.384 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.5 ' OE1' ' N ' ' A' ' 65' ' ' GLU . 2.1 mp0 -138.25 86.42 17.13 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.366 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.553 ' O ' ' O ' ' A' ' 67' ' ' SER . 72.7 Cg_endo -81.02 -103.22 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.939 2.426 . . . . 0.0 112.379 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.581 ' O ' ' C ' ' A' ' 68' ' ' GLN . 3.1 t 29.51 96.18 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.394 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.581 ' C ' ' O ' ' A' ' 67' ' ' SER . 0.7 OUTLIER -15.33 -75.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.415 -179.761 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.574 ' O ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -113.22 -39.7 4.09 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.327 0.584 . . . . 0.0 110.994 -179.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.574 ' OG1' ' O ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER 166.81 -177.77 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.9 m -132.39 131.78 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.316 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.446 ' O ' ' OG1' ' A' ' 73' ' ' THR . . . -69.99 -36.38 75.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.124 0.487 . . . . 0.0 110.826 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' A' ' 72' ' ' ALA . 32.6 m -170.9 -65.51 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.568 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.61 150.46 1.22 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.14 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.567 ' O ' ' O ' ' A' ' 76' ' ' SER . 25.2 Cg_endo -66.14 165.55 23.89 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.562 2.175 . . . . 0.0 111.975 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.567 ' O ' ' O ' ' A' ' 75' ' ' PRO . 5.7 m -35.15 162.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.704 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -102.8 -78.1 0.55 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.229 0.538 . . . . 0.0 110.323 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.441 ' CG1' ' H ' ' A' ' 79' ' ' GLU . 2.0 t -67.01 -138.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.474 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.441 ' H ' ' CG1' ' A' ' 78' ' ' VAL . 12.9 mt-10 -113.37 -94.26 0.46 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.468 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.1 52.37 0.69 Allowed Glycine 0 CA--C 1.526 0.722 0 N-CA-C 111.042 -0.823 . . . . 0.0 111.042 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.0 m -140.49 170.71 15.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.901 0.382 . . . . 0.0 110.797 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -84.68 176.82 8.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.801 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 174.97 -171.61 0.06 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.444 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -103.7 24.59 10.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.492 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.32 173.17 9.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.604 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.598 ' O ' ' O ' ' A' ' 87' ' ' VAL . 3.6 tt0 67.48 97.32 0.06 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.716 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.598 ' O ' ' O ' ' A' ' 86' ' ' GLU . 2.9 m -25.5 151.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.267 -0.878 . . . . 0.0 111.569 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.495 ' H ' HD11 ' A' ' 88' ' ' LEU . 6.4 mp -64.16 -33.58 76.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.398 179.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 54.4 173.31 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.983 179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.32 -151.41 0.47 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.862 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.5 p -78.54 44.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.757 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.461 HD11 HG21 ' A' ' 92' ' ' ILE . 0.1 OUTLIER -52.42 136.42 12.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.95 0.405 . . . . 0.0 110.813 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -154.68 91.63 1.4 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.281 0.562 . . . . 0.0 110.217 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.537 ' HG ' ' H ' ' A' ' 95' ' ' THR . 0.8 OUTLIER -165.37 -51.21 0.03 OUTLIER 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.364 -178.588 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.537 ' H ' ' HG ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -30.2 127.8 0.13 Allowed 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.532 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -105.83 179.67 4.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.726 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.512 ' OD1' ' N ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -116.71 156.2 27.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.712 -179.694 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.684 ' H ' ' ND2' ' A' ' 98' ' ' ASN . 0.0 OUTLIER -88.71 156.48 18.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.338 179.792 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -94.09 -8.01 40.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.764 -179.845 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.462 ' O ' ' CB ' ' A' ' 104' ' ' ALA . 64.2 m-20 -44.29 -18.64 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 99' ' ' LYS . 0.3 OUTLIER -61.52 -58.79 6.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.952 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.652 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 4.6 pp -79.47 -34.65 41.28 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.212 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.548 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -62.57 -40.37 96.64 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.813 0.816 . . . . 0.0 109.392 -179.073 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.462 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -79.2 -56.55 4.27 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.889 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.21 -44.67 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.17 0.509 . . . . 0.0 109.834 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.652 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.9 mm -64.63 -53.15 45.83 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.388 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.91 -50.15 73.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.94 0.4 . . . . 0.0 110.605 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -46.3 78.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.852 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.54 -16.93 53.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.54 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 3.3 tm? -89.91 -14.0 35.13 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.556 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.17 -18.99 22.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.323 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -84.17 -34.15 24.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.976 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.463 ' N ' ' HD2' ' A' ' 114' ' ' PRO . 0.0 OUTLIER -52.07 -55.89 26.79 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.523 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 113' ' ' SER . 62.3 Cg_exo -43.27 152.27 0.26 Allowed 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.619 2.213 . . . . 0.0 111.805 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.26 -161.31 0.85 Allowed 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.25 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.692 ' CG2' ' H ' ' A' ' 117' ' ' GLN . 14.9 mt -128.6 -141.28 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.781 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.692 ' H ' ' CG2' ' A' ' 116' ' ' ILE . 0.2 OUTLIER -79.58 78.26 6.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.568 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -113.34 171.9 7.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.665 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -98.03 -57.31 2.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.566 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.756 0 CA-C-O 118.011 -1.439 . . . . 0.0 110.926 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmm . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.591 ' O ' ' O ' ' A' ' 3' ' ' ALA . 0.6 OUTLIER -119.26 94.97 4.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.564 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.591 ' O ' ' O ' ' A' ' 2' ' ' THR . . . -15.98 -106.39 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.366 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 4' ' ' GLU . 1.2 pt-20 -112.18 166.97 10.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.579 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.679 ' N ' ' CD2' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -96.85 -129.92 0.17 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.468 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.547 ' C ' ' H ' ' A' ' 8' ' ' ASP . 4.7 tt0 39.45 23.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.867 0.365 . . . . 0.0 110.314 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 5' ' ' LEU . 6.9 tt0 -57.53 -2.49 0.13 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.624 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.547 ' H ' ' C ' ' A' ' 6' ' ' GLN . 1.3 m-20 -92.13 -19.45 22.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.27 0.557 . . . . 0.0 110.379 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.419 ' C ' ' H ' ' A' ' 11' ' ' ALA . 17.8 t0 -39.24 -68.96 0.14 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.716 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.64 21.2 0.29 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.255 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.419 ' H ' ' C ' ' A' ' 9' ' ' ASP . . . -106.55 -103.73 0.34 Allowed 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.411 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 92.92 111.68 2.04 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -109.77 -153.21 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.8 0.333 . . . . 0.0 110.396 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -131.24 -1.52 4.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.471 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -83.64 151.45 25.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.54 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 167.03 124.22 0.7 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -117.01 159.21 22.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.805 0.336 . . . . 0.0 110.722 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -176.42 50.05 0.11 Allowed Glycine 0 CA--C 1.525 0.656 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.3 m -133.44 -152.33 0.48 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.78 0.324 . . . . 0.0 110.563 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.98 105.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.465 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.64 ' O ' ' N ' ' A' ' 23' ' ' MET . 0.0 OUTLIER -81.69 162.73 22.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.461 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -41.73 -14.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.334 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.64 ' N ' ' O ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -61.75 -53.73 52.1 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.101 0.476 . . . . 0.0 110.72 -179.798 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.467 HD22 ' H ' ' A' ' 24' ' ' LEU . 3.0 mm? -52.42 -62.75 1.44 Allowed 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.683 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.687 ' CD2' ' H ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -54.51 -43.83 72.2 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.882 -178.567 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.545 ' O ' ' CB ' ' A' ' 30' ' ' GLU . 0.7 OUTLIER -69.43 -42.86 74.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.313 -178.333 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.627 ' O ' ' CG2' ' A' ' 31' ' ' ILE . 3.9 mm-40 -61.29 -52.83 63.05 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.267 -178.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.607 ' CD2' ' H ' ' A' ' 29' ' ' ARG . 1.4 pt? -70.68 -48.6 53.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.519 -178.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.607 ' H ' ' CD2' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.5 -26.6 67.24 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.526 -179.224 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.545 ' CB ' ' O ' ' A' ' 26' ' ' ASN . 29.5 tp10 -87.87 -57.5 2.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.22 0.533 . . . . 0.0 110.47 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.627 ' CG2' ' O ' ' A' ' 27' ' ' GLN . 16.4 tt -54.43 -35.46 31.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.672 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.592 ' OG1' ' O ' ' A' ' 28' ' ' LEU . 46.8 p -92.25 -31.28 15.47 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.722 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 70.25 36.31 70.68 Favored Glycine 0 N--CA 1.462 0.394 0 N-CA-C 109.103 -1.599 . . . . 0.0 109.103 -179.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.609 ' CG2' ' H ' ' A' ' 36' ' ' ASP . 3.8 mm -92.5 152.92 3.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.583 -0.808 . . . . 0.0 112.633 -177.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.452 ' N ' HG22 ' A' ' 34' ' ' ILE . 1.9 mt-30 -122.93 18.75 10.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.483 178.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.666 ' O ' ' N ' ' A' ' 38' ' ' SER . 1.4 m-20 -119.54 65.56 8.92 Favored Pre-proline 0 N--CA 1.455 -0.19 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -35.81 -20.33 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.851 0 C-N-CA 122.973 2.448 . . . . 0.0 111.971 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 36' ' ' ASP . 25.2 t -75.33 -52.68 10.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.787 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -71.1 -24.15 62.24 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.444 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 24.0 mt -66.41 -59.9 3.25 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.337 -1.302 . . . . 0.0 108.917 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.653 ' C ' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -53.89 -40.31 66.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.603 179.51 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -49.88 -48.73 51.23 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' HB3' ' CD2' ' A' ' 58' ' ' LEU . . . -61.67 -59.94 4.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.498 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.465 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 2.2 mm? -45.27 -24.24 0.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.887 0.375 . . . . 0.0 110.017 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.478 ' HD3' ' ND1' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -82.64 -42.24 18.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.792 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.6 -24.29 53.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.474 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 84.1 p -84.92 -2.95 58.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.344 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.7 m120 60.73 26.84 16.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.101 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.97 -24.03 31.85 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 121.027 -0.606 . . . . 0.0 111.75 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.16 102.62 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.697 -0.401 . . . . 0.0 109.947 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.647 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.8 OUTLIER -58.77 -57.41 11.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.873 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.647 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 25.8 m -41.2 -61.28 1.04 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.197 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.49 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 31.9 mt-30 -50.58 -55.99 13.78 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.618 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.21 -54.03 3.02 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.446 ' O ' ' CG2' ' A' ' 59' ' ' THR . 23.4 t -45.57 -59.51 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.221 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.1 t -45.38 -49.24 13.24 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.101 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.551 ' O ' ' NH1' ' A' ' 62' ' ' ARG . 6.5 mp -63.54 -27.62 69.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.811 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.568 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 89.4 mt -91.49 -9.48 44.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.704 -178.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.706 ' C ' ' H ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -131.77 6.71 4.36 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.41 -179.116 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.447 ' HB3' ' CZ ' ' A' ' 62' ' ' ARG . 28.8 t0 -67.14 24.09 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.736 179.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.706 ' H ' ' C ' ' A' ' 59' ' ' THR . 3.5 tm-20 78.35 63.27 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.69 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.756 ' C ' ' H ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -121.97 -110.55 0.33 Allowed 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.476 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 97.4 t 48.94 -5.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.519 179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.756 ' H ' ' C ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -148.02 -139.39 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.474 -179.76 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.494 ' N ' ' CG ' ' A' ' 64' ' ' LYS . 2.5 mm-40 -130.13 78.35 74.84 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.278 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.42 ' O ' ' O ' ' A' ' 65' ' ' GLU . 39.3 Cg_exo -56.51 -142.25 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.813 2.342 . . . . 0.0 112.159 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.734 ' HG ' ' H ' ' A' ' 69' ' ' ASP . 0.2 OUTLIER -145.22 -163.8 1.8 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.567 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.638 ' CD ' ' H ' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -62.62 -14.87 48.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.734 ' H ' ' HG ' ' A' ' 67' ' ' SER . 0.9 OUTLIER -54.73 -19.02 5.39 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.178 0.513 . . . . 0.0 110.57 -179.826 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.2 p -96.8 -118.53 0.12 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.468 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.414 ' O ' ' CG2' ' A' ' 71' ' ' VAL . 1.0 OUTLIER -68.99 134.3 30.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.499 179.931 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -52.51 -32.55 40.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.396 0.617 . . . . 0.0 110.133 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.685 ' CG2' ' H ' ' A' ' 74' ' ' GLU . 4.2 m -87.51 -166.21 1.52 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.942 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.685 ' H ' ' CG2' ' A' ' 73' ' ' THR . 6.8 tt0 48.2 81.02 0.27 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.78 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.452 ' O ' ' O ' ' A' ' 74' ' ' GLU . 50.6 Cg_exo -48.79 -172.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.754 2.303 . . . . 0.0 111.943 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.448 ' OG ' ' N ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -144.18 -174.53 4.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.887 0.375 . . . . 0.0 110.615 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.448 ' N ' ' OG ' ' A' ' 76' ' ' SER . 41.8 mt-10 -78.54 -76.11 0.21 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.543 0.687 . . . . 0.0 110.594 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.721 ' CG2' ' H ' ' A' ' 79' ' ' GLU . 6.5 p -111.75 -146.53 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.339 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.721 ' H ' ' CG2' ' A' ' 78' ' ' VAL . 83.6 mt-10 -132.11 163.34 28.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.647 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 70.5 102.88 0.04 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.53 -174.16 2.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.683 0.277 . . . . 0.0 110.359 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -43.34 164.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.463 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.473 ' O ' ' C ' ' A' ' 84' ' ' ASN . . . -93.05 -35.12 13.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.298 0.57 . . . . 0.0 110.375 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.473 ' C ' ' O ' ' A' ' 83' ' ' ALA . 1.4 m-80 32.75 76.38 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.667 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -123.65 -176.23 3.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.229 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.92 -9.35 44.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.701 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.8 t -147.04 121.39 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.006 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.445 ' N ' HD12 ' A' ' 88' ' ' LEU . 5.4 mp -87.01 -26.6 23.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.511 0.672 . . . . 0.0 109.298 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 48.85 92.24 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.665 -1.152 . . . . 0.0 111.005 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.654 ' O ' ' N ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -120.66 -164.06 1.07 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.615 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 22.0 t 40.52 13.32 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.418 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.654 ' N ' ' O ' ' A' ' 90' ' ' LYS . 2.6 pt -40.55 128.44 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.336 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -170.29 116.53 0.52 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.95 0.405 . . . . 0.0 110.673 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.7 mp -154.81 -88.83 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.124 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.715 ' CG2' ' H ' ' A' ' 96' ' ' HIS . 1.3 t -126.3 -91.17 0.53 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.443 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.715 ' H ' ' CG2' ' A' ' 95' ' ' THR . 1.7 p80 -104.11 -126.74 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.304 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.553 ' C ' ' O ' ' A' ' 96' ' ' HIS . 1.5 t0 26.22 45.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.765 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.531 ' CG ' ' H ' ' A' ' 99' ' ' LYS . 0.7 OUTLIER -86.91 -131.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.713 -179.86 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.531 ' H ' ' CG ' ' A' ' 98' ' ' ASN . 3.5 pttp -84.25 -96.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.159 0.504 . . . . 0.0 110.703 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.462 ' O ' ' CB ' ' A' ' 104' ' ' ALA . 41.4 m-20 -43.83 -20.82 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.521 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' A' ' 99' ' ' LYS . 2.9 t0 -63.07 -58.35 7.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.872 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.666 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 3.9 pp -78.85 -32.71 46.16 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.085 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.601 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 2.1 tt0 -65.3 -38.86 91.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.761 0.791 . . . . 0.0 109.733 -178.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.462 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -78.79 -49.92 12.19 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.93 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.435 0.636 . . . . 0.0 109.399 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.666 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -63.46 -43.43 98.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.975 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.83 80.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.186 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.92 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.58 -20.71 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.183 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.573 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -83.8 -27.83 28.53 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.57 0.7 . . . . 0.0 109.143 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.555 ' O ' ' C ' ' A' ' 112' ' ' GLU . 0.4 OUTLIER -56.61 -85.93 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.823 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.555 ' C ' ' O ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -21.04 -59.75 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.849 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 110' ' ' LEU . 1.2 t -76.89 113.12 27.18 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.21 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.99 -109.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.332 2.021 . . . . 0.0 112.194 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -139.98 -178.95 5.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.753 0.311 . . . . 0.0 110.528 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.822 ' CG2' ' H ' ' A' ' 117' ' ' GLN . 8.6 tt -75.41 -101.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.827 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.822 ' H ' ' CG2' ' A' ' 116' ' ' ILE . 3.2 pt20 -68.39 61.76 0.09 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.732 0.301 . . . . 0.0 110.845 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.583 ' O ' ' O ' ' A' ' 117' ' ' GLN . . . -49.53 -114.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.701 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -125.84 -38.87 2.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.67 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.747 0 CA-C-O 117.922 -1.488 . . . . 0.0 111.087 -179.821 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.508 ' CG ' ' N ' ' A' ' 2' ' ' THR . 1.5 ptp . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.508 ' N ' ' CG ' ' A' ' 1' ' ' MET . 33.0 m -97.73 -51.82 3.96 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.619 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.44 ' C ' ' O ' ' A' ' 2' ' ' THR . . . 36.4 -142.34 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.422 ' O ' ' C ' ' A' ' 5' ' ' LEU . 1.5 tp10 54.1 -162.77 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.777 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' GLU . 1.2 mt 38.12 -142.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.524 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 5' ' ' LEU . 36.8 tt0 37.61 86.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.748 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -70.3 -3.46 17.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.683 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.86 -20.49 42.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.108 0.48 . . . . 0.0 110.49 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.567 ' O ' ' O ' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -72.94 -18.41 61.39 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.355 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.567 ' O ' ' O ' ' A' ' 9' ' ' ASP . . . 39.11 102.81 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.685 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -128.32 34.82 4.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.663 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -106.3 -53.61 0.73 Allowed Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 14' ' ' ALA . . . -97.29 -172.64 2.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.81 0.338 . . . . 0.0 110.593 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 13' ' ' ALA . . . 38.77 -165.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.548 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -155.25 179.15 9.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.496 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 149.02 -70.66 0.32 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.611 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 0.2 OUTLIER -42.11 103.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.797 0.332 . . . . 0.0 110.482 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 169.75 81.18 0.05 OUTLIER Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.497 ' O ' ' OG ' ' A' ' 19' ' ' SER . 4.3 p -131.64 53.97 1.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.879 0.371 . . . . 0.0 110.619 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m 53.63 -175.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.679 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.2 m -123.86 104.83 9.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.497 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.402 ' HG3' ' CE ' ' A' ' 23' ' ' MET . 3.3 pt20 -73.06 -12.5 60.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.838 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.452 ' N ' ' HE3' ' A' ' 23' ' ' MET . 0.0 OUTLIER -58.68 -31.31 68.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.128 0.489 . . . . 0.0 110.687 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 24' ' ' LEU . 6.0 mp -62.1 -62.64 1.63 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.083 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.477 ' H ' HD21 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -64.81 -44.7 89.06 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.9 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -56.52 -59.48 4.92 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.243 0.544 . . . . 0.0 110.865 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -52.4 -50.2 62.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.607 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.428 ' CG ' HD23 ' A' ' 44' ' ' LEU . 5.1 mt -44.76 -59.32 2.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.362 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -69.32 -20.49 63.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.095 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.97 -21.36 40.39 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.788 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 30.8 mt -98.5 -50.76 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.387 0.613 . . . . 0.0 111.491 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.537 ' HG1' ' N ' ' A' ' 33' ' ' GLY . 3.0 p -85.6 -37.21 19.8 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.492 -178.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.537 ' N ' ' HG1' ' A' ' 32' ' ' THR . . . 76.95 36.11 37.1 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.584 HG21 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -97.15 154.8 3.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.973 0.416 . . . . 0.0 111.203 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -121.65 23.5 10.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.044 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 38' ' ' SER . 2.4 t70 -121.98 73.73 36.36 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.366 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_exo -36.99 -21.14 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.954 2.436 . . . . 0.0 112.37 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 36' ' ' ASP . 9.3 m -68.57 -54.27 17.68 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.841 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.622 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -75.5 -26.57 58.25 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.606 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 10.6 mt -61.31 -60.29 3.97 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.465 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -52.6 -50.75 62.43 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.754 179.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 41' ' ' HIS . 25.1 tt0 -40.33 -47.28 2.49 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.48 ' HB3' ' CD1' ' A' ' 58' ' ' LEU . . . -60.4 -49.63 76.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.066 178.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.509 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -58.01 -25.22 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.437 179.671 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 41' ' ' HIS . 11.3 mmmt -79.07 -38.98 35.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.94 0.4 . . . . 0.0 110.433 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.6 -26.62 41.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.106 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.487 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 1.9 p -88.32 10.36 20.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.262 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.0 OUTLIER 49.88 30.78 4.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.723 0.297 . . . . 0.0 110.888 179.624 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.51 -23.42 35.15 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.445 ' O ' ' OG ' ' A' ' 47' ' ' SER . 29.6 t0 -63.03 96.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.029 0.442 . . . . 0.0 110.172 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.62 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.0 OUTLIER -56.35 -52.73 48.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.572 -178.973 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.62 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.4 m -50.82 -46.11 59.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.052 0.453 . . . . 0.0 110.929 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.5 ' O ' ' CD1' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -65.86 -53.56 38.2 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.653 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.428 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.45 -54.56 3.07 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 52' ' ' THR . 42.6 t -46.62 -57.17 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.757 177.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.55 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 1.4 t -49.39 -45.97 46.73 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.993 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.5 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.9 mp -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.506 HD21 ' CE2' ' A' ' 39' ' ' PHE . 79.8 mt -86.16 -23.95 26.36 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.899 -178.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.602 ' C ' ' H ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -125.52 14.5 8.19 Favored 'General case' 0 C--N 1.312 -1.048 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.104 -178.133 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.55 ' OD2' ' O ' ' A' ' 56' ' ' SER . 2.1 m-20 -73.36 24.61 0.07 Allowed 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.602 ' H ' ' C ' ' A' ' 59' ' ' THR . 2.8 tp10 74.11 66.66 0.09 Allowed 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.458 ' HD3' ' N ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER -132.98 -53.14 0.91 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.466 -177.658 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.597 ' O ' ' O ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -43.2 -84.43 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.997 -178.596 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.597 ' O ' ' O ' ' A' ' 63' ' ' VAL . 0.1 OUTLIER 28.93 -155.04 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.621 -179.763 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.402 ' H ' ' HB2' ' A' ' 64' ' ' LYS . 0.7 OUTLIER -143.37 78.1 15.06 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-O 121.088 0.471 . . . . 0.0 110.586 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.585 ' O ' ' O ' ' A' ' 67' ' ' SER . 69.5 Cg_endo -86.23 -158.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 123.202 2.601 . . . . 0.0 112.225 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 66' ' ' PRO . 0.1 OUTLIER 42.42 -178.21 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.833 179.786 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.498 ' CG ' ' H ' ' A' ' 69' ' ' ASP . 0.3 OUTLIER -138.87 -117.4 0.14 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.502 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.498 ' H ' ' CG ' ' A' ' 68' ' ' GLN . 6.9 m-20 -104.56 -19.13 14.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.294 0.569 . . . . 0.0 110.175 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.449 ' HG1' ' C ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -162.64 -164.24 0.99 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.338 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 2.6 m -158.69 139.2 4.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.444 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.538 ' C ' ' OG1' ' A' ' 73' ' ' THR . . . -82.39 -36.76 26.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.186 0.517 . . . . 0.0 110.541 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.538 ' OG1' ' C ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER 171.38 -85.85 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.996 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.764 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -109.02 -15.44 0.13 Allowed Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.764 ' CD ' ' N ' ' A' ' 74' ' ' GLU . 72.7 Cg_endo -79.74 -107.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.347 0 C-N-CA 121.919 1.746 . . . . 0.0 112.48 -179.272 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.563 ' O ' ' C ' ' A' ' 77' ' ' GLU . 0.4 OUTLIER 36.04 -86.37 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.039 0.447 . . . . 0.0 110.822 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.657 ' N ' ' O ' ' A' ' 75' ' ' PRO . 13.8 mp0 -21.64 -59.64 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.16 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.74 ' CG1' ' H ' ' A' ' 79' ' ' GLU . 6.5 t -77.61 -141.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.647 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.74 ' H ' ' CG1' ' A' ' 78' ' ' VAL . 63.2 mt-10 -144.55 -104.47 0.11 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.686 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -136.8 -143.4 4.6 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.1 m -142.36 176.19 9.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.769 0.319 . . . . 0.0 110.636 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -44.3 118.84 1.63 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.778 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.59 -151.45 0.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.627 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 -125.28 18.99 8.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.2 166.8 9.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.43 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 178.51 -26.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.652 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -111.09 153.09 12.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.803 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.449 ' N ' HD21 ' A' ' 88' ' ' LEU . 3.6 mm? -63.72 -33.48 75.74 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.685 0.755 . . . . 0.0 110.063 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 67.26 -179.63 0.22 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 114.425 -1.261 . . . . 0.0 110.619 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.566 ' O ' ' C ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -125.49 -84.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.001 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.566 ' C ' ' O ' ' A' ' 90' ' ' LYS . 7.1 p 19.4 53.98 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.112 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.811 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.554 ' O ' ' OD2' ' A' ' 93' ' ' ASP . 10.4 mt 62.61 -122.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.718 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.566 ' O ' ' CG ' ' A' ' 93' ' ' ASP . 0.0 OUTLIER 85.54 104.8 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 121.383 0.611 . . . . 0.0 109.377 -179.415 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' A' ' 96' ' ' HIS . 1.3 mt -133.14 -68.23 0.59 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.022 -178.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.46 ' O ' ' OG1' ' A' ' 95' ' ' THR . 0.4 OUTLIER -73.0 13.93 0.34 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.002 -179.637 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.557 ' CE1' ' OD1' ' A' ' 93' ' ' ASP . 0.4 OUTLIER -74.61 154.92 38.33 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.844 0.354 . . . . 0.0 110.689 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.91 108.76 21.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.785 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 177.07 -19.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.448 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -74.36 -78.51 0.1 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.52 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -52.23 -17.58 1.18 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.336 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -61.9 -58.7 6.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.494 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.661 ' O ' ' CG1' ' A' ' 106' ' ' ILE . 3.6 pp -76.74 -31.12 56.91 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.61 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.591 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -64.1 -39.72 94.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.783 0.801 . . . . 0.0 109.486 -178.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.55 -56.39 4.75 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.209 -1.36 . . . . 0.0 110.438 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.47 39.14 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.661 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -50.46 -65.84 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.317 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.02 15.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.55 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.23 -28.68 69.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.666 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.424 ' N ' ' O ' ' A' ' 106' ' ' ILE . 0.6 OUTLIER -99.59 -16.65 18.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.043 -179.025 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.516 ' O ' ' CD1' ' A' ' 110' ' ' LEU . 0.2 OUTLIER -97.94 -10.47 24.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.552 0.691 . . . . 0.0 109.659 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.682 ' C ' ' H ' ' A' ' 113' ' ' SER . 20.7 mt -128.63 -158.75 0.9 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.254 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.424 ' N ' ' HD2' ' A' ' 114' ' ' PRO . 6.2 tm-20 67.93 -27.69 0.14 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.202 0.525 . . . . 0.0 110.575 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.755 ' N ' ' CD ' ' A' ' 114' ' ' PRO . 0.2 OUTLIER -86.17 -32.91 0.45 Allowed Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.545 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . 0.755 ' CD ' ' N ' ' A' ' 113' ' ' SER . 20.9 Cg_endo -82.11 -151.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.731 2.288 . . . . 0.0 111.923 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.401 ' HG3' ' H ' ' A' ' 116' ' ' ILE . 3.7 tptt -115.29 -176.77 2.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.836 0.351 . . . . 0.0 110.834 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.401 ' H ' ' HG3' ' A' ' 115' ' ' LYS . 7.0 mt -110.14 -9.83 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.371 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.93 101.02 13.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.766 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 44.42 -143.87 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.859 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -81.9 -42.07 20.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.566 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.75 0 CA-C-O 117.955 -1.469 . . . . 0.0 110.916 -179.952 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.447 ' O ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.477 ' O ' ' O ' ' A' ' 3' ' ' ALA . 12.6 t -66.35 145.33 55.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.611 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' A' ' 2' ' ' THR . . . -50.7 -172.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.546 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -62.58 163.04 9.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.445 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.71 ' CD2' ' H ' ' A' ' 5' ' ' LEU . 0.0 OUTLIER -116.93 171.29 8.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.657 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.637 ' C ' ' H ' ' A' ' 8' ' ' ASP . 4.5 mm100 -67.61 -64.98 0.75 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.336 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 55.28 -2.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.942 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.637 ' H ' ' C ' ' A' ' 6' ' ' GLN . 2.4 m-20 -109.7 -25.48 10.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.179 0.514 . . . . 0.0 110.759 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -57.02 -28.98 62.98 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.04 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.13 165.98 28.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.632 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -155.6 -25.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.627 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 118.01 -162.49 13.1 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.475 ' O ' ' C ' ' A' ' 14' ' ' ALA . . . -78.78 -156.44 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.72 0.295 . . . . 0.0 110.648 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.475 ' C ' ' O ' ' A' ' 13' ' ' ALA . . . 33.33 -137.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.556 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.414 ' CG ' ' H ' ' A' ' 16' ' ' GLY . 22.5 t0 -70.12 -168.88 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.619 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.414 ' H ' ' CG ' ' A' ' 15' ' ' ASP . . . 126.78 108.38 1.55 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.959 -0.857 . . . . 0.0 110.959 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -116.35 174.64 5.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.8 0.333 . . . . 0.0 110.721 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -128.89 119.11 2.9 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.775 ' HG ' ' H ' ' A' ' 20' ' ' SER . 53.7 p -104.32 -111.06 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.813 0.34 . . . . 0.0 110.636 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.775 ' H ' ' HG ' ' A' ' 19' ' ' SER . 0.3 OUTLIER 75.42 -6.0 2.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.423 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 90.2 m -97.18 128.73 44.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.217 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -81.61 -28.13 33.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.892 -179.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -23.17 49.23 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.95 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mt -69.13 -63.35 1.08 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.276 0.56 . . . . 0.0 110.926 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -33.61 76.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.439 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.48 -56.99 12.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.077 0.465 . . . . 0.0 110.195 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.415 ' O ' ' N ' ' A' ' 30' ' ' GLU . 24.3 mm-40 -55.78 -59.87 4.26 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.509 -0.768 . . . . 0.0 109.996 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.423 HD23 ' CD2' ' A' ' 44' ' ' LEU . 10.3 tp -46.6 -51.66 15.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.8 179.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttt180 -63.78 -21.4 66.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.8 tt0 -84.63 -21.91 30.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.579 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 44.3 mt -94.35 -50.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.493 0.663 . . . . 0.0 111.311 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.517 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.5 p -85.52 -37.83 19.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.397 -178.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.36 36.32 17.67 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.522 HG23 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -97.57 143.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.736 0.303 . . . . 0.0 110.351 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -114.89 23.38 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.863 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.586 ' O ' ' N ' ' A' ' 38' ' ' SER . 0.4 OUTLIER -113.83 73.19 2.21 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.338 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -35.11 -24.21 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.938 2.425 . . . . 0.0 112.503 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.2 OUTLIER -71.4 -52.31 19.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.797 179.783 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.678 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -71.19 -28.38 64.18 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.916 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.48 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mp -70.3 -48.35 57.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -62.18 -27.25 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.228 178.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -65.19 -48.38 73.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.504 ' CB ' ' CD1' ' A' ' 58' ' ' LEU . . . -62.2 -47.46 84.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.465 ' N ' HD21 ' A' ' 44' ' ' LEU . 4.1 mm? -55.64 -42.58 75.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.189 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.458 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 5.0 tmtt? -74.44 -27.19 60.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.763 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.458 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -79.2 -24.15 43.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.084 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.787 ' HG ' ' N ' ' A' ' 54' ' ' ALA . 0.4 OUTLIER -96.2 17.01 16.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.162 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 61.95 22.13 12.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.195 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.78 -23.53 33.55 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -62.96 124.03 20.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.632 ' CG2' ' N ' ' A' ' 52' ' ' THR . 4.1 tt -74.72 -55.49 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.077 -179.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.632 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.0 m -43.46 -54.19 4.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 0.0 110.169 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.624 ' CB ' ' HG ' ' A' ' 47' ' ' SER . 25.6 mt-30 -57.73 -54.52 45.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.787 ' N ' ' HG ' ' A' ' 47' ' ' SER . . . -40.37 -51.18 2.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 58' ' ' LEU . 18.1 t -50.38 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.024 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.0 t -41.94 -48.31 4.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.286 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.495 ' CD1' ' O ' ' A' ' 53' ' ' GLN . 6.6 mp -63.09 -29.82 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.934 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.572 ' CD2' ' CZ ' ' A' ' 39' ' ' PHE . 37.7 mt -89.93 -11.19 42.46 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -177.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.484 ' CG2' ' O ' ' A' ' 55' ' ' VAL . 0.4 OUTLIER -117.79 -10.27 10.53 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.832 -179.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -61.24 -56.16 23.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.315 0.578 . . . . 0.0 110.542 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.474 ' CD ' ' C ' ' A' ' 61' ' ' GLU . 0.4 OUTLIER 178.82 92.21 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.598 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.791 HH11 ' H ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -125.16 -94.11 0.48 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.187 0.518 . . . . 0.0 112.218 -178.6 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.526 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -87.46 -22.22 6.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.829 -178.296 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.791 ' H ' HH11 ' A' ' 62' ' ' ARG . 0.0 OUTLIER -51.83 146.85 7.56 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.477 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.522 ' O ' ' O ' ' A' ' 66' ' ' PRO . 2.1 mt-10 -105.0 102.08 33.71 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.797 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.522 ' O ' ' O ' ' A' ' 65' ' ' GLU . 50.7 Cg_exo -52.2 -131.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.637 2.224 . . . . 0.0 112.194 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 68' ' ' GLN . 43.5 t -179.58 -27.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.876 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.462 ' O ' ' O ' ' A' ' 67' ' ' SER . 3.5 mm100 -51.78 -108.4 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.826 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.17 -17.31 35.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.211 0.529 . . . . 0.0 110.721 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.7 p -100.76 135.99 41.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.69 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.563 ' CG1' ' H ' ' A' ' 72' ' ' ALA . 39.1 t -141.19 173.98 8.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.771 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.563 ' H ' ' CG1' ' A' ' 71' ' ' VAL . . . -115.3 -90.73 0.54 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.067 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 m -153.07 -68.8 0.15 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.38 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.658 ' H ' ' CD ' ' A' ' 75' ' ' PRO . 0.8 OUTLIER -110.43 -40.53 0.11 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.7 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.658 ' CD ' ' H ' ' A' ' 74' ' ' GLU . 28.3 Cg_exo -58.38 -172.37 0.05 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.613 2.208 . . . . 0.0 111.939 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.95 -154.38 0.05 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.581 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -47.29 -82.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.19 0.519 . . . . 0.0 110.366 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.434 ' CG1' ' H ' ' A' ' 79' ' ' GLU . 2.9 t -114.95 -129.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.479 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.434 ' H ' ' CG1' ' A' ' 78' ' ' VAL . 5.2 mt-10 -123.23 -105.51 0.36 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.583 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -119.18 -96.57 1.7 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 m -120.6 -168.99 1.73 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -42.66 -85.66 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.793 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -95.79 160.21 14.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.457 ' O ' ' O ' ' A' ' 85' ' ' LYS . 0.7 OUTLIER -155.34 16.16 0.4 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.224 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.472 ' CG ' ' H ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -58.56 -131.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.956 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.472 ' H ' ' CG ' ' A' ' 85' ' ' LYS . 53.4 tt0 -86.09 -17.27 35.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.633 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.499 HG11 ' H ' ' A' ' 89' ' ' ALA . 4.1 t -127.96 140.11 50.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.499 ' H ' HD13 ' A' ' 88' ' ' LEU . 5.0 mp -78.46 -27.77 46.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.135 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.499 ' H ' HG11 ' A' ' 87' ' ' VAL . . . 51.3 178.87 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.421 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.447 ' C ' ' H ' ' A' ' 92' ' ' ILE . 0.2 OUTLIER -138.53 -143.69 0.17 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.916 -179.695 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.569 ' O ' ' C ' ' A' ' 92' ' ' ILE . 2.5 t -73.21 45.86 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.371 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.569 ' C ' ' O ' ' A' ' 91' ' ' VAL . 17.7 pt -19.41 128.43 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.162 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -175.55 110.77 0.11 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.552 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.613 ' CG ' ' H ' ' A' ' 95' ' ' THR . 0.2 OUTLIER -131.2 -80.19 0.53 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.988 -179.158 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.737 ' OG1' ' N ' ' A' ' 96' ' ' HIS . 0.3 OUTLIER 40.22 -160.76 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.136 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.737 ' N ' ' OG1' ' A' ' 95' ' ' THR . 52.6 m80 62.8 164.1 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.713 0.292 . . . . 0.0 110.516 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -113.84 126.85 55.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.15 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.617 ' C ' ' H ' ' A' ' 100' ' ' ASP . 2.4 t-20 61.35 177.38 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.332 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.444 ' C ' ' H ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER 48.48 6.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.081 179.516 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.617 ' H ' ' C ' ' A' ' 98' ' ' ASN . 42.2 m-20 -50.45 -14.69 0.19 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.889 0.376 . . . . 0.0 110.426 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.444 ' H ' ' C ' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -65.12 -62.99 1.22 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.785 -178.963 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.772 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.19 -17.24 46.88 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.717 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.528 ' N ' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -71.46 -37.16 71.38 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.84 -49.49 20.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.159 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.46 76.45 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.713 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.5 mm -53.96 -48.17 63.86 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.986 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.12 -34.49 73.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.049 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 tp -69.64 -22.7 63.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.561 ' O ' ' O ' ' A' ' 113' ' ' SER . 0.6 OUTLIER -107.11 -18.93 13.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.56 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 28.5 tp -92.39 -27.06 17.75 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.206 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.37 -24.85 17.21 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.162 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.0 -20.2 17.55 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.816 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 114' ' ' PRO . 0.3 OUTLIER -161.06 171.26 7.22 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.61 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . 0.58 ' O ' ' O ' ' A' ' 113' ' ' SER . 50.6 Cg_exo -49.03 -157.66 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.613 2.208 . . . . 0.0 112.019 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.435 ' CG ' ' H ' ' A' ' 116' ' ' ILE . 2.4 ptmt -101.06 -120.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.405 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.566 ' O ' ' N ' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -120.25 155.26 23.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.308 179.864 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.563 ' C ' ' O ' ' A' ' 116' ' ' ILE . 0.0 OUTLIER -21.7 88.25 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.803 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 116' ' ' ILE . . . 40.03 -132.64 0.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.529 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.14 -24.22 5.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.336 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.765 0 CA-C-O 118.014 -1.437 . . . . 0.0 110.832 179.989 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 tpp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.564 ' O ' ' CG2' ' A' ' 2' ' ' THR . 13.3 t -71.23 79.73 0.71 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.675 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.545 ' C ' ' O ' ' A' ' 2' ' ' THR . . . 29.72 -94.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.93 0.395 . . . . 0.0 109.987 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.548 ' N ' ' O ' ' A' ' 2' ' ' THR . 13.2 pm0 -102.06 -138.23 0.34 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.173 179.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.692 ' N ' ' CD2' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -178.34 -168.09 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.854 -179.711 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.631 ' O ' ' N ' ' A' ' 8' ' ' ASP . 2.1 tt0 -160.82 31.03 0.15 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.818 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.58 -11.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.939 0.399 . . . . 0.0 110.612 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.631 ' N ' ' O ' ' A' ' 6' ' ' GLN . 0.3 OUTLIER -65.98 -18.9 65.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.289 179.771 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.652 ' CG ' ' H ' ' A' ' 10' ' ' ALA . 5.0 p-10 -50.97 -65.38 0.57 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.019 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.652 ' H ' ' CG ' ' A' ' 9' ' ' ASP . . . -89.63 -170.34 2.8 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.951 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.0 -52.49 0.12 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.518 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 13' ' ' ALA . . . 76.66 106.0 0.14 Allowed Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.564 ' O ' ' C ' ' A' ' 14' ' ' ALA . . . 26.31 -109.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.823 0.344 . . . . 0.0 110.906 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.564 ' C ' ' O ' ' A' ' 13' ' ' ALA . . . -23.4 131.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.856 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -178.29 0.33 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.493 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -52.61 172.97 0.33 Allowed Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -163.09 54.79 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.833 0.349 . . . . 0.0 110.366 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -154.05 99.38 0.19 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 94.9 p -106.94 -27.32 10.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.737 0.303 . . . . 0.0 110.661 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.508 ' OG ' ' N ' ' A' ' 21' ' ' CYS . 0.9 OUTLIER 60.88 -160.28 0.3 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.45 -179.85 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.632 ' O ' ' CD2' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -74.91 111.58 10.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.389 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.15 -14.83 57.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.024 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.589 ' O ' ' OE1' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -69.96 -28.5 65.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.998 0.428 . . . . 0.0 111.199 -179.563 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.432 HD11 ' N ' ' A' ' 24' ' ' LEU . 6.7 mp -71.33 -62.85 1.25 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.406 0.622 . . . . 0.0 110.674 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.782 ' CD2' ' H ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -58.34 -42.37 86.7 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.395 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -62.57 -56.5 17.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.14 0.495 . . . . 0.0 110.841 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.679 ' OE1' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -49.73 -63.42 1.12 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.494 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.463 HD12 ' CD1' ' A' ' 44' ' ' LEU . 1.1 mt -51.84 -51.65 55.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.013 0.435 . . . . 0.0 111.072 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -22.56 46.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.552 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.35 -32.07 22.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.463 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.8 mt -78.9 -55.86 8.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.536 0.684 . . . . 0.0 110.943 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.529 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -78.09 -37.32 46.7 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.762 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.9 36.75 12.68 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -179.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.541 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -98.1 149.43 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.957 0.408 . . . . 0.0 110.851 -179.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -119.56 23.37 11.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.155 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.671 ' O ' ' N ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -120.03 69.04 13.47 Favored Pre-proline 0 N--CA 1.453 -0.325 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.982 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -35.51 -20.45 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.864 2.376 . . . . 0.0 112.044 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.671 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.1 OUTLIER -74.76 -53.26 9.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.438 -179.328 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.69 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -69.78 -24.39 63.5 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.72 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.511 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 2.2 mt -67.47 -59.42 3.39 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.749 ' CE1' ' NZ ' ' A' ' 45' ' ' LYS . 1.2 t-80 -53.91 -26.39 24.87 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.814 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -64.95 -47.55 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.39 82.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.66 178.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 44' ' ' LEU . 4.6 mm? -56.14 -36.86 68.73 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.749 ' NZ ' ' CE1' ' A' ' 41' ' ' HIS . 25.9 mttp -68.93 -46.66 67.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.734 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.6 -22.12 64.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.918 0.39 . . . . 0.0 110.708 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.523 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 62.4 p -90.57 17.6 7.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.489 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.531 ' ND2' ' OD2' ' A' ' 50' ' ' ASP . 0.6 OUTLIER 48.57 30.27 2.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.0 -23.5 35.44 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.531 ' OD2' ' ND2' ' A' ' 48' ' ' ASN . 89.9 m-20 -58.26 115.44 2.95 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.138 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.6 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.2 OUTLIER -69.27 -58.36 5.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.898 -179.255 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.6 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.5 m -45.51 -57.15 4.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.012 0.434 . . . . 0.0 110.575 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.523 ' O ' HD13 ' A' ' 57' ' ' LEU . 8.9 mm100 -51.51 -59.09 4.64 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.609 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.407 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -39.03 -54.76 1.66 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.478 0.656 . . . . 0.0 109.338 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.472 ' O ' ' CG2' ' A' ' 59' ' ' THR . 41.2 t -45.18 -59.19 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.48 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 53' ' ' GLN . 5.0 t -43.93 -49.69 8.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.642 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.59 ' O ' ' NE ' ' A' ' 62' ' ' ARG . 5.2 mp -60.23 -30.31 69.32 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.249 0.547 . . . . 0.0 110.439 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.558 ' CD2' ' CZ ' ' A' ' 39' ' ' PHE . 41.4 mt -88.07 -14.53 38.66 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.082 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.663 ' C ' ' H ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER -122.97 7.8 9.29 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.351 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.637 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -63.29 19.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.124 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.663 ' H ' ' C ' ' A' ' 59' ' ' THR . 20.6 tp10 92.32 55.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.133 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.59 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -128.56 -90.99 0.49 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.204 0.526 . . . . 0.0 110.513 179.829 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.554 ' H ' ' CG ' ' A' ' 62' ' ' ARG . 9.2 t -64.05 -75.74 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.989 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 63' ' ' VAL . 4.2 mtmt 82.88 -158.81 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.496 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.48 ' OE2' ' O ' ' A' ' 32' ' ' THR . 36.0 mt-10 -145.51 153.16 51.12 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.302 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.596 ' O ' ' C ' ' A' ' 67' ' ' SER . 17.2 Cg_exo -52.73 -80.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 121.985 1.79 . . . . 0.0 112.07 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.708 ' O ' ' N ' ' A' ' 70' ' ' THR . 79.9 p 6.11 -105.58 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.794 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.524 ' C ' ' O ' ' A' ' 67' ' ' SER . 78.3 mm-40 -28.83 -49.16 0.07 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.833 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 66' ' ' PRO . 0.9 OUTLIER -63.74 -37.61 88.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.36 0.6 . . . . 0.0 110.789 -179.636 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.708 ' N ' ' O ' ' A' ' 67' ' ' SER . 1.2 p -150.2 138.36 20.32 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.315 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.626 ' CG2' ' H ' ' A' ' 72' ' ' ALA . 2.3 p -116.11 -152.06 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.902 0.382 . . . . 0.0 110.63 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.626 ' H ' ' CG2' ' A' ' 71' ' ' VAL . . . -145.82 -83.08 0.14 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.489 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.401 ' H ' ' HB3' ' A' ' 72' ' ' ALA . 85.5 m -55.69 -103.39 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.514 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.497 ' CB ' ' CD ' ' A' ' 75' ' ' PRO . 3.3 mt-10 -136.54 -65.66 0.02 OUTLIER Pre-proline 0 C--N 1.332 -0.189 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.1 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.497 ' CD ' ' CB ' ' A' ' 74' ' ' GLU . 28.6 Cg_endo -64.67 -176.17 0.41 Allowed 'Trans proline' 0 N--CA 1.494 1.532 0 C-N-CA 122.335 2.023 . . . . 0.0 112.058 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.01 128.29 41.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.764 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -60.37 -11.54 6.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.475 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.477 ' CG1' ' H ' ' A' ' 79' ' ' GLU . 8.7 t -135.28 -124.3 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.495 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.477 ' H ' ' CG1' ' A' ' 78' ' ' VAL . 5.3 pt-20 -113.52 -164.59 0.93 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.588 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -97.81 -178.54 33.54 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.3 m -99.25 167.48 10.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.926 0.394 . . . . 0.0 110.653 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.497 ' O ' ' O ' ' A' ' 83' ' ' ALA . . . -81.26 -86.07 0.09 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.766 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.497 ' O ' ' O ' ' A' ' 82' ' ' ALA . . . 41.46 -169.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.687 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -172.88 -2.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.127 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -67.31 -160.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.398 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.451 ' C ' ' CG2' ' A' ' 87' ' ' VAL . 2.6 tp10 59.44 75.31 0.41 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.442 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.451 ' CG2' ' C ' ' A' ' 86' ' ' GLU . 1.1 t -152.63 125.85 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.123 0.487 . . . . 0.0 111.004 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.474 HD22 ' H ' ' A' ' 88' ' ' LEU . 0.6 OUTLIER -74.84 -28.34 60.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.685 0.755 . . . . 0.0 109.33 179.162 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 64.09 -160.73 0.29 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.522 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.04 148.75 31.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.019 0.438 . . . . 0.0 110.979 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.442 ' O ' ' C ' ' A' ' 92' ' ' ILE . 7.6 p -132.98 -1.1 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.278 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.442 ' C ' ' O ' ' A' ' 91' ' ' VAL . 41.9 mm 38.5 -100.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.984 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.429 ' N ' ' CG2' ' A' ' 92' ' ' ILE . 0.8 OUTLIER 167.51 112.54 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.096 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.603 ' O ' ' NE2' ' A' ' 96' ' ' HIS . 2.5 mp -137.92 -87.68 0.26 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.659 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 t -64.04 122.03 15.56 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.028 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.603 ' NE2' ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -105.55 -158.82 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.912 179.531 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -108.51 89.16 2.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.158 179.803 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -112.01 -109.63 0.35 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.576 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.601 ' CG ' ' H ' ' A' ' 100' ' ' ASP . 0.9 OUTLIER -126.09 -143.55 0.3 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.73 0.776 . . . . 0.0 113.046 -178.116 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.601 ' H ' ' CG ' ' A' ' 99' ' ' LYS . 2.5 p30 -71.56 -19.79 62.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.968 -179.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -53.38 -60.64 3.04 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.107 -179.924 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.756 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.21 -23.48 30.47 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.871 179.267 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.514 ' H ' HD11 ' A' ' 102' ' ' LEU . 1.1 mt-30 -67.94 -38.4 82.78 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 118.985 -1.086 . . . . 0.0 108.953 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.74 -51.98 9.03 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.689 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.62 -44.44 85.52 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.425 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -64.47 -43.87 96.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.038 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.27 -53.14 53.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.978 0.418 . . . . 0.0 110.793 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.7 tt -54.77 -43.54 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.751 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.446 ' O ' ' N ' ' A' ' 113' ' ' SER . 0.5 OUTLIER -84.61 -19.85 32.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.47 -179.33 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.584 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 3.7 tt -82.11 -19.31 40.35 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.103 0.478 . . . . 0.0 109.787 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.0 tp -62.24 -21.37 65.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.39 178.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -130.99 -57.61 1.03 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.134 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.446 ' N ' ' O ' ' A' ' 109' ' ' SER . 4.8 t 40.35 88.0 0.1 Allowed Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.028 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -65.94 -80.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 123.013 2.476 . . . . 0.0 111.867 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -111.6 -140.22 0.38 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.614 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.55 ' O ' ' C ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -115.98 155.35 17.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.31 179.814 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.55 ' C ' ' O ' ' A' ' 116' ' ' ILE . 2.5 pt20 24.29 94.12 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.948 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -125.42 173.17 9.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.564 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -141.96 -77.87 0.26 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.677 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.745 0 CA-C-O 117.988 -1.451 . . . . 0.0 110.952 -179.924 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HB2' HD11 ' A' ' 51' ' ' ILE . 14.0 mm-40 . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.501 HD23 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -45.62 -51.62 11.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.065 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 29' ' ' ARG . 1.7 mtp180 -64.06 -22.23 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.617 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 27' ' ' GLN . 45.0 mt-10 -85.46 -20.2 30.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.847 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.7 HD13 HG21 ' A' ' 55' ' ' VAL . 16.6 mt -93.83 -50.84 11.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.575 0.702 . . . . 0.0 111.396 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.531 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 1.6 p -92.69 -38.0 12.08 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.143 -177.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.42 35.97 35.58 Favored Glycine 0 CA--C 1.522 0.5 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.697 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -90.81 150.5 3.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.054 0.454 . . . . 0.0 111.057 -179.113 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.423 ' H ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -114.38 23.74 12.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.988 -179.113 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.697 ' H ' HG22 ' A' ' 34' ' ' ILE . 40.1 t0 -120.64 74.37 24.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.156 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -36.07 -25.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.929 2.419 . . . . 0.0 112.177 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -73.13 -51.62 17.28 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.09 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.925 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.31 -27.44 64.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -69.45 -55.94 8.84 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.311 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -58.14 -25.17 61.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.386 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -66.29 -49.1 68.23 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.915 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -58.14 -44.85 88.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.248 179.11 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.501 HD21 HD23 ' A' ' 28' ' ' LEU . 3.7 mm? -63.05 -34.0 76.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.011 0.434 . . . . 0.0 110.097 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 1.4 tmtm? -72.9 -30.8 64.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.033 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.454 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.42 -28.79 28.61 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.245 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.709 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 1.1 m -84.5 3.59 35.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.423 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 68.54 21.31 8.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.166 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.66 0.35 49.43 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.479 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.28 130.57 34.55 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.139 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.562 HG22 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -78.01 -52.2 16.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.512 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.562 ' N ' HG22 ' A' ' 51' ' ' ILE . 28.5 m -52.26 -53.2 46.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 111.268 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.487 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 mm-40 -59.39 -56.77 17.84 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.427 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.709 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -41.69 -57.31 2.34 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-O 122.193 0.997 . . . . 0.0 108.593 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.7 HG21 HD13 ' A' ' 31' ' ' ILE . 2.1 t -43.02 -57.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.454 -1.703 . . . . 0.0 108.324 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.453 ' N ' HG12 ' A' ' 55' ' ' VAL . 2.7 t -46.73 -52.94 12.85 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.164 178.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 13.7 mt -50.18 -38.97 42.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.219 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.925 HD22 ' CE2' ' A' ' 39' ' ' PHE . 21.0 mt -81.03 -53.81 6.1 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.123 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.675 HG23 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.683 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.234 0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 110.879 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.697 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.1 pp -82.11 -30.31 31.27 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.697 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.6 0.714 . . . . 0.0 109.881 -178.809 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -80.94 -48.48 12.24 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.232 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.78 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.693 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -65.63 -42.72 93.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.838 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.12 -48.2 68.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.966 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -38.56 83.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.66 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -20.7 25.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 111.461 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.557 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 23.1 tp . . . . . 0 C--N 1.32 -0.698 0 CA-C-O 121.537 0.684 . . . . 0.0 109.459 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.406 ' HB3' HD13 ' A' ' 51' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.101 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.838 HD22 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -53.26 -51.65 61.57 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.302 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -23.01 63.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.631 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.29 -44.12 16.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.546 HG21 HG11 ' A' ' 55' ' ' VAL . 63.1 mt -69.81 -54.78 17.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.416 0.627 . . . . 0.0 111.438 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.511 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 4.7 p -76.13 -36.59 58.75 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.553 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.2 36.15 60.24 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.957 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.7 mm -90.62 151.29 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.173 0.511 . . . . 0.0 111.703 -178.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -119.33 23.26 11.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.707 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.957 ' H ' HG22 ' A' ' 34' ' ' ILE . 46.5 t0 -120.37 69.92 15.85 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.212 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HA ' HD12 ' A' ' 40' ' ' LEU . 83.1 Cg_exo -36.94 -21.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.753 2.302 . . . . 0.0 111.707 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -75.41 -52.74 10.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.356 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.762 ' CE1' HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.22 -26.23 64.71 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.587 HD22 HD12 ' A' ' 28' ' ' LEU . 14.1 mt -66.33 -55.93 13.6 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -50.85 -37.18 41.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.598 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -58.22 -45.37 87.81 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -58.26 -54.11 50.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.027 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.838 HD21 HD22 ' A' ' 28' ' ' LEU . 3.8 mm? -62.64 -20.22 64.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.278 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -79.01 -54.13 6.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.973 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.26 -29.48 69.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 4.0 p -76.15 -16.75 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m120 68.24 33.37 4.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.498 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.48 -20.97 42.63 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 47' ' ' SER . 36.0 m-20 -68.53 118.46 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.832 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.1 OUTLIER -74.18 -53.17 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.52 -179.726 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.611 ' N ' HG22 ' A' ' 51' ' ' ILE . 39.3 m -45.76 -55.52 6.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.344 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.35 -57.35 11.6 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.674 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.86 -47.65 4.26 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 109.785 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.985 ' O ' HG22 ' A' ' 59' ' ' THR . 24.6 t -53.95 -59.75 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.817 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -54.59 -44.82 73.37 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.806 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 54' ' ' ALA . 10.3 mt -58.09 -36.23 72.56 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.485 0.66 . . . . 0.0 110.893 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.762 HD23 ' CE1' ' A' ' 39' ' ' PHE . 7.2 mp -84.35 -40.23 18.14 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.787 -1.097 . . . . 0.0 113.268 -177.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.985 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.5 t . . . . . 0 C--N 1.318 -0.802 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.84 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.237 0.403 0 CA-C-O 120.635 0.255 . . . . 0.0 111.091 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.083 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.95 -19.71 36.65 Favored 'General case' 0 C--O 1.216 -0.666 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.442 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.908 ' N ' HD22 ' A' ' 102' ' ' LEU . 2.6 mt-30 -67.77 -36.69 80.95 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.504 -0.879 . . . . 0.0 108.769 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.34 -52.36 8.21 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.516 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.57 -45.5 85.11 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.679 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.1 mm -62.73 -45.8 97.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.988 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.06 91.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.247 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.26 -40.53 94.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.843 0.354 . . . . 0.0 110.346 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -18.02 32.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.902 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 1.001 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.2 tm? . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.62 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.863 0.364 . . . . 0.0 110.489 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.637 ' HB3' HD23 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -45.49 -55.78 5.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.803 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -67.31 -20.94 65.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.61 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -80.75 -24.14 38.9 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.449 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.576 HG21 HG11 ' A' ' 55' ' ' VAL . 46.2 mt -95.8 -54.83 6.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.571 0.7 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.441 ' OG1' HG13 ' A' ' 34' ' ' ILE . 5.8 p -78.88 -37.92 38.94 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.78 -178.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.79 36.04 30.02 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.746 HD12 ' CZ ' ' A' ' 39' ' ' PHE . 1.1 mm -98.74 144.78 11.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.789 0.328 . . . . 0.0 110.964 -179.153 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.522 ' OE1' ' N ' ' A' ' 35' ' ' GLN . 3.3 mp0 -113.35 22.7 13.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.658 ' H ' HG22 ' A' ' 34' ' ' ILE . 1.5 m-20 -111.46 71.6 0.89 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.354 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' CG ' ' A' ' 41' ' ' HIS . 78.2 Cg_exo -35.31 -22.71 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.752 2.301 . . . . 0.0 111.92 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.638 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -74.06 -49.59 23.41 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.869 179.881 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.821 ' CE1' HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -73.92 -29.83 62.25 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.648 HD12 ' O ' ' A' ' 36' ' ' ASP . 1.7 mp -69.96 -49.81 48.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.462 -0.79 . . . . 0.0 108.87 177.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.442 ' CG ' ' O ' ' A' ' 37' ' ' PRO . 18.5 m170 -67.06 -24.02 65.93 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.464 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -68.17 -39.02 82.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.752 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -63.87 -50.12 70.06 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.963 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.597 HD21 HD12 ' A' ' 28' ' ' LEU . 81.7 mt -65.4 -24.38 67.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.942 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.8 -31.2 45.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.174 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.9 -35.6 26.01 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.928 0.394 . . . . 0.0 110.076 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.57 ' O ' ' OD1' ' A' ' 48' ' ' ASN . 72.3 p -84.28 12.55 6.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.705 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 47' ' ' SER . 24.0 p30 47.4 37.98 6.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.778 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.36 -24.0 32.42 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.244 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.09 104.46 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 117.267 0.534 . . . . 0.0 109.981 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.645 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.3 OUTLIER -60.77 -55.58 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.183 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.645 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.9 m -40.88 -57.55 1.93 Allowed 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.322 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 54' ' ' ALA . 8.6 mt-30 -51.18 -55.01 20.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.696 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.824 ' HA ' HD12 ' A' ' 57' ' ' LEU . . . -41.75 -44.63 3.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.46 0.648 . . . . 0.0 109.704 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.946 ' O ' HG22 ' A' ' 59' ' ' THR . 13.7 t -59.22 -59.6 3.61 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.75 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.3 t -52.95 -38.15 61.77 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.593 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 54' ' ' ALA . 8.7 mt -67.34 -40.56 85.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.264 0.554 . . . . 0.0 111.285 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.821 HD23 ' CE1' ' A' ' 39' ' ' PHE . 6.9 mp -80.37 -38.98 29.37 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.682 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.946 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.3 t . . . . . 0 C--N 1.317 -0.841 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.756 -178.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.285 0 CA-C-O 120.458 0.17 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.117 HD23 ' N ' ' A' ' 103' ' ' GLN . 0.5 OUTLIER -83.23 -28.83 28.94 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.486 179.458 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 1.117 ' N ' HD23 ' A' ' 102' ' ' LEU . 1.1 tt0 -63.26 -39.03 93.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.912 0.863 . . . . 0.0 109.364 -179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -80.31 -54.64 5.54 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.141 -1.39 . . . . 0.0 111.169 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.41 -44.34 76.13 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.351 0.596 . . . . 0.0 109.471 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.668 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -67.37 -41.86 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.364 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.51 89.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -38.97 89.6 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.178 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.65 -18.04 34.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.098 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 1.028 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.791 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 110.621 -0.14 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.751 ' HB2' HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -52.6 -55.08 24.86 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.594 -179.386 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.426 ' CD ' ' C ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -63.54 -21.63 66.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.352 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -87.64 -20.32 26.5 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.462 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.0 mt -97.43 -53.53 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-O 121.529 0.68 . . . . 0.0 111.085 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.516 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.1 p -77.85 -36.65 49.69 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.95 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.2 35.78 52.33 Favored Glycine 0 CA--C 1.519 0.288 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.919 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.8 mm -92.72 155.64 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.118 0.485 . . . . 0.0 111.68 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.43 ' N ' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -118.9 23.2 11.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.41 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.919 ' H ' HG22 ' A' ' 34' ' ' ILE . 4.5 m-20 -125.27 75.94 68.3 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.979 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.559 ' HA ' HD12 ' A' ' 40' ' ' LEU . 85.6 Cg_exo -39.26 -20.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.597 2.198 . . . . 0.0 111.563 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.575 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -73.67 -53.89 9.37 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.676 -179.407 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.986 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.94 -25.6 62.81 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.569 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.751 HD22 ' HB2' ' A' ' 28' ' ' LEU . 9.6 mt -64.74 -54.68 27.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -57.81 -30.59 65.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.088 179.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.18 -44.35 95.63 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.025 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -65.82 -42.36 90.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.259 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.632 ' CD2' HD13 ' A' ' 28' ' ' LEU . 4.4 mm? -62.5 -31.97 72.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.146 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.31 -29.39 34.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.183 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.44 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -77.45 -42.48 35.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.393 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.633 ' OG ' ' HB2' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -72.41 14.13 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.653 0.263 . . . . 0.0 111.007 -179.39 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 46' ' ' ALA . 3.7 m-20 60.42 26.32 15.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.473 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.27 -23.38 34.54 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.48 127.52 31.9 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.595 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.4 OUTLIER -77.56 -57.63 5.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.125 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.595 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 14.4 m -47.84 -45.98 30.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.065 0.46 . . . . 0.0 110.506 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 41.8 mt-30 -61.71 -55.8 26.46 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.633 ' HB2' ' OG ' ' A' ' 47' ' ' SER . . . -41.47 -58.29 1.94 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.139 0.971 . . . . 0.0 108.511 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.881 ' O ' HG22 ' A' ' 59' ' ' THR . 18.1 t -43.56 -54.38 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.754 178.232 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.5 t -52.43 -44.95 65.74 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.612 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 16.9 mt -57.45 -34.59 69.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.26 0.552 . . . . 0.0 110.888 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.025 HD21 ' HB2' ' A' ' 43' ' ' ALA . 13.8 mt -87.84 -26.89 22.57 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -177.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.881 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.677 0 C-N-CA 120.094 -0.643 . . . . 0.0 111.26 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.0 t70 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.504 0.193 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.108 HD23 ' N ' ' A' ' 103' ' ' GLN . 0.4 OUTLIER -83.42 -29.04 28.43 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 120.244 -0.582 . . . . 0.0 110.705 179.786 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 1.108 ' N ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -64.4 -40.72 96.34 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.529 -0.869 . . . . 0.0 109.341 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -55.59 4.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.919 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.88 -46.61 71.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.159 0.504 . . . . 0.0 109.669 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.686 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.3 mm -62.58 -47.93 90.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.996 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.29 98.58 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.223 -178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -41.02 98.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -18.37 36.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.091 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.994 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.2 tm? . . . . . 0 C--N 1.32 -0.683 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.528 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' N ' ' A' ' 30' ' ' GLU . 2.6 mm-40 . . . . . 0 CA--C 1.522 -0.119 0 CA-C-O 121.038 0.447 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.962 HD22 ' CD2' ' A' ' 44' ' ' LEU . 12.4 tp -44.68 -54.27 6.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.97 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -63.03 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.374 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 27' ' ' GLN . 29.6 tt0 -79.29 -21.21 46.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.998 0.428 . . . . 0.0 110.398 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.448 HG21 HG11 ' A' ' 55' ' ' VAL . 59.4 mt -93.96 -44.29 13.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.383 0.611 . . . . 0.0 111.215 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.533 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.1 p -91.44 -37.45 13.18 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.312 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.99 34.77 10.48 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.64 HG21 ' CD1' ' A' ' 39' ' ' PHE . 1.1 mm -100.09 142.27 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.773 0.321 . . . . 0.0 110.39 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -113.85 23.29 13.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.792 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.635 ' O ' ' N ' ' A' ' 38' ' ' SER . 36.4 t0 -112.52 72.51 1.31 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -34.96 -22.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.691 0 C-N-CA 122.877 2.385 . . . . 0.0 112.336 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.635 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.8 OUTLIER -73.68 -52.66 12.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.938 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 1.075 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -72.26 -26.01 61.83 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.943 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.643 HD23 HD23 ' A' ' 28' ' ' LEU . 1.2 mp -71.91 -53.17 13.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -60.72 -24.92 66.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.128 178.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -65.79 -46.11 79.93 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.922 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -61.53 -51.52 68.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.071 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.962 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.3 mm? -55.04 -36.27 65.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.207 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 4.4 tmtt? -76.54 -28.74 56.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.446 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.469 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.32 -20.88 33.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.914 0.388 . . . . 0.0 110.735 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.42 ' OG ' ' HB2' ' A' ' 53' ' ' GLN . 42.2 t -93.02 -6.83 47.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.381 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.521 ' N ' ' OD1' ' A' ' 48' ' ' ASN . 0.6 OUTLIER 74.75 26.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.055 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.12 -21.59 41.07 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.35 123.64 20.93 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.73 ' O ' HG23 ' A' ' 55' ' ' VAL . 2.2 tt -75.56 -56.03 9.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.036 -179.15 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.639 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.2 m -46.09 -52.34 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.809 0.337 . . . . 0.0 110.662 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.615 ' O ' HD12 ' A' ' 57' ' ' LEU . 28.1 mt-30 -59.64 -53.68 55.23 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.37 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.0 -53.52 2.95 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.855 ' O ' HG22 ' A' ' 59' ' ' THR . 39.5 t -47.73 -58.73 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.949 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.2 t -46.02 -48.53 16.74 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.249 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.615 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.6 mp -62.53 -27.64 69.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.199 0.523 . . . . 0.0 111.02 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.075 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 52.6 mt -90.31 -14.02 34.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.853 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.855 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.568 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.329 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 C--O 1.236 0.345 0 CA-C-O 120.604 0.24 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.906 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -81.39 -22.52 38.24 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.73 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.889 ' N ' HD22 ' A' ' 102' ' ' LEU . 23.1 mt-30 -66.71 -40.84 88.61 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.677 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.95 -53.22 9.37 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.362 -1.29 . . . . 0.0 111.026 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.68 -51.52 68.43 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.663 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -55.38 -45.01 77.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.938 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.89 -31.04 69.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.136 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -28.0 63.27 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.013 0.435 . . . . 0.0 109.854 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.7 -18.66 16.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 106' ' ' ILE . 4.7 tt . . . . . 0 C--N 1.32 -0.679 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.571 -178.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.146 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.88 HD23 HD23 ' A' ' 40' ' ' LEU . 11.1 tp -46.45 -51.86 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.554 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -60.91 -21.29 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.437 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.467 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.3 tt0 -86.43 -24.25 25.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.48 HD12 ' HA ' ' A' ' 28' ' ' LEU . 31.3 mt -87.26 -53.35 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 CA-C-O 121.889 0.852 . . . . 0.0 110.537 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.496 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.7 p -82.63 -37.29 25.16 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.048 -1.433 . . . . 0.0 111.675 -178.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.28 35.34 17.96 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.694 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -99.41 142.42 15.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.893 0.378 . . . . 0.0 110.827 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -112.96 23.35 13.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.46 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.694 ' H ' HG22 ' A' ' 34' ' ' ILE . 15.2 m-20 -112.39 73.94 1.46 Allowed Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.441 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -35.36 -24.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.605 2.203 . . . . 0.0 112.021 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.611 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -71.88 -52.98 14.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.258 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 1.032 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.99 -25.21 62.6 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.766 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.88 HD23 HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -71.84 -47.84 50.27 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.771 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -65.26 -26.96 68.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.123 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.51 -53.77 42.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.903 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -59.69 -38.37 81.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.261 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.75 ' CD2' HD22 ' A' ' 28' ' ' LEU . 3.3 mm? -67.36 -30.12 69.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.934 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -77.26 -33.94 55.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.11 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.489 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -81.86 -37.9 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.749 -179.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 48' ' ' ASN . 32.0 p -67.53 -12.75 61.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.757 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.411 ' CB ' ' O ' ' A' ' 47' ' ' SER . 8.4 t-20 74.03 37.79 0.61 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.83 -23.58 30.25 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -67.71 125.61 26.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.833 0.349 . . . . 0.0 110.281 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.633 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.6 OUTLIER -78.02 -57.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -179.636 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.633 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 18.5 m -45.39 -53.04 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.937 0.399 . . . . 0.0 110.568 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.68 ' O ' HD12 ' A' ' 57' ' ' LEU . 44.9 mt-30 -55.69 -55.33 33.47 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.283 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.412 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.33 -54.04 3.12 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.586 0.708 . . . . 0.0 109.149 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.635 ' O ' HG22 ' A' ' 59' ' ' THR . 61.6 t -47.57 -56.96 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.635 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -51.28 -46.67 62.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.306 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.68 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.1 mp -60.2 -34.54 73.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 0.0 111.327 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.032 HD22 ' CE2' ' A' ' 39' ' ' PHE . 18.8 mt -81.44 -58.18 3.14 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.428 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.773 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.672 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.0 t70 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.677 0.275 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.961 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.5 pp -76.25 -32.03 58.66 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.364 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.961 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.9 OUTLIER -63.41 -38.49 91.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.724 0.774 . . . . 0.0 109.508 -179.028 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.51 -56.41 4.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.595 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.64 -55.02 29.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.667 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.6 mm -51.89 -52.96 19.72 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.754 179.16 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.86 73.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.057 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.774 HD23 ' O ' ' A' ' 108' ' ' LEU . 8.6 tt -58.18 -32.52 68.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.884 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.06 -18.14 22.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.984 0.421 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.981 ' O ' HD12 ' A' ' 110' ' ' LEU . 1.1 tp . . . . . 0 C--N 1.319 -0.751 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.71 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.756 0.312 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.756 HD13 HD21 ' A' ' 44' ' ' LEU . 6.6 tp -52.88 -57.93 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.908 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -59.4 -21.52 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.29 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.2 -35.01 25.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.826 0.346 . . . . 0.0 110.769 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.612 HG21 HG11 ' A' ' 55' ' ' VAL . 38.6 mt -73.0 -52.41 22.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-O 121.659 0.743 . . . . 0.0 110.684 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.477 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.0 p -79.74 -35.32 39.02 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.609 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 67.28 36.15 89.11 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.812 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -89.32 155.71 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.256 -0.472 . . . . 0.0 111.705 -178.2 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -122.26 23.35 9.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.608 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.812 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -119.77 70.09 13.41 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -34.83 -20.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.962 2.441 . . . . 0.0 112.221 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.669 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -73.73 -52.43 13.23 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.632 179.66 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.953 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.33 -25.38 64.18 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.514 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mt -69.61 -59.79 2.74 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.723 ' HD1' ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -57.51 -27.57 62.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.447 179.136 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.723 ' N ' ' HD1' ' A' ' 41' ' ' HIS . 62.9 tt0 -61.3 -56.77 16.74 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.67 179.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.935 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -58.56 -38.7 78.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.756 HD21 HD13 ' A' ' 28' ' ' LEU . 2.0 mm? -67.59 -24.9 65.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.96 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.449 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.43 -30.59 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.179 179.237 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.449 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -82.07 -36.95 27.12 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.813 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.584 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 41.4 t -72.58 -16.24 61.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 73.6 36.38 0.78 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.956 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.66 -23.69 35.13 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.584 ' O ' ' OG ' ' A' ' 47' ' ' SER . 0.4 OUTLIER -66.97 116.08 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.943 ' O ' HG23 ' A' ' 55' ' ' VAL . 1.7 tt -70.15 -50.88 43.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.408 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.638 ' N ' HG23 ' A' ' 51' ' ' ILE . 54.4 m -50.87 -61.44 2.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.289 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.721 ' O ' HD12 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -49.85 -56.24 11.19 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.887 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.05 -55.18 2.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.943 HG23 ' O ' ' A' ' 51' ' ' ILE . 21.4 t -47.24 -58.57 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.746 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.6 t -48.47 -50.08 32.97 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.721 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.0 mp -55.4 -36.78 66.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.196 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.953 HD22 ' CE2' ' A' ' 39' ' ' PHE . 25.5 mt -80.5 -62.21 1.74 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.941 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.647 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.314 -0.956 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.542 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.008 HD23 ' H ' ' A' ' 103' ' ' GLN . 0.9 OUTLIER -77.18 -34.76 56.25 Favored 'General case' 0 C--O 1.21 -0.976 0 C-N-CA 120.304 -0.559 . . . . 0.0 112.425 -178.441 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 1.008 ' H ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -63.22 -35.66 81.08 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.806 0.812 . . . . 0.0 109.561 -178.766 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.68 -56.57 4.2 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.442 -1.253 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.62 -47.7 73.12 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.518 0.675 . . . . 0.0 109.289 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.675 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.8 mm -61.08 -46.72 96.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.612 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.771 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 103' ' ' GLN . . . -60.39 -45.7 92.62 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.85 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.3 tp -59.62 -43.33 93.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.647 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.0 -19.17 34.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.245 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.963 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 . . . . . 0 CA--C 1.527 0.082 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.816 HD22 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -51.33 -48.72 62.33 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 119.807 -0.757 . . . . 0.0 110.479 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.75 -22.35 65.23 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.141 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -85.86 -20.86 28.48 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.981 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 94.1 mt -94.49 -38.8 9.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-O 121.6 0.714 . . . . 0.0 110.927 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 28' ' ' LEU . 11.4 p -94.89 -35.39 12.05 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.794 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.74 36.0 58.39 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.842 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -93.72 152.22 3.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.246 -0.477 . . . . 0.0 111.237 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -120.73 23.59 10.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.035 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.842 ' H ' HG22 ' A' ' 34' ' ' ILE . 10.2 t70 -120.16 74.24 21.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.5 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.551 ' HA ' HD12 ' A' ' 40' ' ' LEU . 66.7 Cg_exo -37.28 -20.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.666 2.244 . . . . 0.0 111.683 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.633 ' O ' ' ND1' ' A' ' 41' ' ' HIS . 0.7 OUTLIER -69.95 -54.0 15.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.549 -179.449 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.923 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -74.42 -26.39 60.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 10.6 mt -63.08 -46.88 85.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.633 ' ND1' ' O ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -67.57 -36.42 80.89 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.796 179.174 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.571 ' N ' ' CD2' ' A' ' 41' ' ' HIS . 4.9 tt0 -51.89 -49.12 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.551 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.049 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -69.29 -56.83 6.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.564 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.816 HD21 HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -45.33 -25.79 0.44 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.407 ' N ' ' C ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -83.78 -49.38 9.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.347 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.422 ' C ' ' H ' ' A' ' 48' ' ' ASN . . . -64.12 -41.98 97.02 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.75 0.309 . . . . 0.0 110.968 -179.207 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 6.8 p -68.09 4.65 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.809 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 46' ' ' ALA . 3.2 m-80 56.48 33.22 22.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.7 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.79 -23.6 35.27 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' OG ' ' A' ' 47' ' ' SER . 11.7 m-20 -62.45 106.13 0.72 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.649 HG22 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -63.78 -58.4 7.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.691 -179.379 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.649 ' N ' HG22 ' A' ' 51' ' ' ILE . 23.1 m -43.89 -46.19 7.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.122 0.487 . . . . 0.0 110.336 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.662 ' O ' HD12 ' A' ' 57' ' ' LEU . 1.8 mp0 -64.74 -53.54 45.53 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -42.02 -54.02 3.68 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.947 ' O ' HG22 ' A' ' 59' ' ' THR . 69.1 t -46.72 -58.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.126 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -48.86 -46.98 43.13 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.98 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.9 mp -62.27 -34.3 76.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.132 0.491 . . . . 0.0 111.413 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.049 HD21 ' HB2' ' A' ' 43' ' ' ALA . 18.9 mt -87.89 -14.1 40.26 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -177.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.947 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.4 t . . . . . 0 C--N 1.32 -0.701 0 C-N-CA 119.523 -0.871 . . . . 0.0 112.887 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.279 0 CA-C-O 120.385 0.136 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.038 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.77 -20.56 30.83 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.845 179.027 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.891 ' N ' HD22 ' A' ' 102' ' ' LEU . 3.2 mt-30 -68.34 -35.63 78.05 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -81.06 -49.66 10.61 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.352 -1.295 . . . . 0.0 110.61 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.92 -42.27 97.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.674 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.0 mm -65.07 -50.04 76.45 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.792 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.08 -47.92 84.1 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.9 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.43 -43.69 88.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.771 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -18.94 38.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.175 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 2.4 tt . . . . . 0 C--N 1.32 -0.692 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.424 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' GLU . 12.3 mm-40 . . . . . 0 C--O 1.232 0.182 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.852 HD23 HD23 ' A' ' 40' ' ' LEU . 15.9 tp -45.42 -49.84 12.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.411 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 1.1 tmt_? -63.27 -20.57 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.161 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 27' ' ' GLN . 4.8 tp10 -84.39 -22.07 30.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.127 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.516 HD12 ' HA ' ' A' ' 28' ' ' LEU . 13.7 mt -92.5 -52.98 9.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.727 0.775 . . . . 0.0 110.72 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.444 ' OG1' HG13 ' A' ' 34' ' ' ILE . 9.7 p -81.76 -36.8 28.12 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.378 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 29' ' ' ARG . . . 79.14 35.78 29.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.703 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -98.57 140.66 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.989 0.423 . . . . 0.0 111.201 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -112.06 22.64 14.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.318 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.703 ' H ' HG22 ' A' ' 34' ' ' ILE . 4.4 t70 -110.67 74.44 0.92 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.979 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -35.88 -25.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.723 2.282 . . . . 0.0 112.393 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -68.9 -53.11 22.94 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 1.056 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -73.17 -24.97 60.62 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.154 0.502 . . . . 0.0 109.652 -179.794 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.852 HD23 HD23 ' A' ' 28' ' ' LEU . 0.6 OUTLIER -69.67 -51.43 34.74 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.625 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -24.97 63.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.94 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -68.31 -39.16 82.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.955 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -68.93 -55.68 10.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.446 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.84 ' CD1' HD22 ' A' ' 28' ' ' LEU . 7.5 mp -53.86 -36.75 62.95 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.25 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -53.99 37.15 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.56 -24.89 50.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.74 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.58 -7.65 49.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 65.88 39.01 4.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.811 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.53 -23.39 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.517 ' C ' ' OD1' ' A' ' 50' ' ' ASP . 16.4 t0 -64.17 93.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.651 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.5 tt -50.59 -57.87 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.143 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.651 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 38.6 m -42.07 -53.46 3.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.98 0.419 . . . . 0.0 110.28 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.656 ' O ' HD12 ' A' ' 57' ' ' LEU . 7.8 mt-30 -57.04 -53.89 52.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.209 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.538 ' HB1' HD12 ' A' ' 44' ' ' LEU . . . -40.38 -57.3 1.81 Allowed 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.615 HG22 HD12 ' A' ' 28' ' ' LEU . 40.3 t -46.62 -60.75 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.856 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -42.39 -49.71 5.17 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.741 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.656 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.3 mp -60.43 -36.66 78.7 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.696 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.056 HD22 ' CE2' ' A' ' 39' ' ' PHE . 11.5 mt -90.84 -11.01 40.61 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.171 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.457 HG21 HG12 ' A' ' 55' ' ' VAL . 82.2 p . . . . . 0 C--N 1.317 -0.812 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.624 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 37.6 t70 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.438 0.161 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.8 HD22 ' N ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -83.5 -24.83 31.55 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.069 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.8 ' N ' HD22 ' A' ' 102' ' ' LEU . 4.9 mt-30 -68.08 -39.89 82.82 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 118.992 -1.083 . . . . 0.0 109.3 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -51.57 9.03 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.744 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.14 78.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 5.4 mm -61.55 -57.98 9.62 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.788 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -51.85 -44.68 63.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 110.921 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.5 tp -59.3 -40.96 87.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.715 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.04 -17.13 36.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.413 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.958 ' O ' HD12 ' A' ' 110' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.687 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.804 0.335 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.902 HD22 ' CD2' ' A' ' 44' ' ' LEU . 40.8 tp -47.77 -55.99 8.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.696 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -62.1 -25.99 68.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.897 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 29' ' ' ARG . 10.4 mt-10 -76.54 -27.29 55.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.026 0.441 . . . . 0.0 110.375 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.607 HG21 HG11 ' A' ' 55' ' ' VAL . 54.4 mt -85.1 -43.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.787 0.803 . . . . 0.0 110.618 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 28' ' ' LEU . 7.7 p -90.6 -34.73 15.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.469 -178.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 81.71 35.36 22.5 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.761 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -94.95 148.47 5.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.895 0.379 . . . . 0.0 111.007 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -117.83 23.25 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.212 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.761 ' H ' HG22 ' A' ' 34' ' ' ILE . 17.2 m-20 -119.45 72.83 14.74 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.637 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.533 ' HA ' HD12 ' A' ' 40' ' ' LEU . 67.8 Cg_exo -36.37 -20.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.79 2.326 . . . . 0.0 112.036 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -72.51 -53.76 11.15 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.728 -1.123 . . . . 0.0 111.387 -179.245 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.825 ' CZ ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.13 -28.41 64.27 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.609 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 8.5 mt -62.35 -51.97 65.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.7 m80 -59.69 -33.98 72.27 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.721 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -56.32 -47.76 78.08 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.006 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -63.83 -54.24 38.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.732 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.902 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.3 mm? -46.89 -37.36 8.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.866 0.365 . . . . 0.0 110.325 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -80.79 -28.53 36.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.323 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.466 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -77.31 -21.62 53.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.118 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.504 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 59.7 p -101.02 17.78 21.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.77 0.319 . . . . 0.0 110.987 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.504 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.6 OUTLIER 48.89 32.16 3.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.151 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.08 -24.29 31.69 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.451 ' O ' ' OG ' ' A' ' 47' ' ' SER . 25.4 m-20 -65.57 99.7 0.45 Allowed 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.386 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.1 tt -57.58 -56.73 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.864 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.662 ' N ' HG23 ' A' ' 51' ' ' ILE . 55.4 m -43.55 -60.13 1.88 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.021 0.438 . . . . 0.0 110.071 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.563 ' O ' HD12 ' A' ' 57' ' ' LEU . 24.1 mt-30 -50.13 -57.98 6.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.635 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.642 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -38.48 -58.39 1.03 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.978 ' O ' HG22 ' A' ' 59' ' ' THR . 11.0 t -42.69 -57.46 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.091 0 CA-C-N 115.29 -0.868 . . . . 0.0 108.722 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.456 ' N ' ' O ' ' A' ' 53' ' ' GLN . 6.8 t -48.47 -47.32 38.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.359 -1.291 . . . . 0.0 110.919 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.563 HD12 ' O ' ' A' ' 53' ' ' GLN . 4.2 mp -59.65 -36.34 76.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.092 0.472 . . . . 0.0 110.988 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.006 HD21 ' HB2' ' A' ' 43' ' ' ALA . 27.5 mt -81.18 -22.65 38.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.797 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.978 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.644 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.19 -178.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.172 0 CA-C-O 120.789 0.328 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.877 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.6 pp -79.47 -34.65 41.28 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.212 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.877 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -62.57 -40.37 96.64 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.813 0.816 . . . . 0.0 109.392 -179.073 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.2 -56.55 4.27 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.889 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.21 -44.67 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.17 0.509 . . . . 0.0 109.834 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.652 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.9 mm -64.63 -53.15 45.83 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.388 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.91 -50.15 73.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.94 0.4 . . . . 0.0 110.605 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.405 ' HA ' HD13 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -55.89 -46.3 78.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.852 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.54 -16.93 53.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.995 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.321 -0.668 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.556 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.766 ' O ' HG22 ' A' ' 31' ' ' ILE . 3.9 mm-40 . . . . . 0 C--O 1.226 -0.155 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.84 HD23 ' H ' ' A' ' 29' ' ' ARG . 1.4 pt? -70.68 -48.6 53.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.519 -178.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.84 ' H ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.5 -26.6 67.24 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.526 -179.224 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -87.87 -57.5 2.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.22 0.533 . . . . 0.0 110.47 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.766 HG22 ' O ' ' A' ' 27' ' ' GLN . 16.4 tt -54.43 -35.46 31.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.672 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.523 HG23 HG23 ' A' ' 31' ' ' ILE . 46.8 p -92.25 -31.28 15.47 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.722 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 70.25 36.31 70.68 Favored Glycine 0 N--CA 1.462 0.394 0 N-CA-C 109.103 -1.599 . . . . 0.0 109.103 -179.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.998 HG22 ' H ' ' A' ' 36' ' ' ASP . 3.8 mm -92.5 152.92 3.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.583 -0.808 . . . . 0.0 112.633 -177.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -122.93 18.75 10.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.483 178.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.998 ' H ' HG22 ' A' ' 34' ' ' ILE . 1.4 m-20 -119.54 65.56 8.92 Favored Pre-proline 0 N--CA 1.455 -0.19 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.61 ' HA ' HD12 ' A' ' 40' ' ' LEU . 70.6 Cg_exo -35.81 -20.33 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.851 0 C-N-CA 122.973 2.448 . . . . 0.0 111.971 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 36' ' ' ASP . 25.2 t -75.33 -52.68 10.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.787 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.727 ' CE1' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.1 -24.15 62.24 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.617 HD22 ' HG ' ' A' ' 28' ' ' LEU . 24.0 mt -66.41 -59.9 3.25 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.337 -1.302 . . . . 0.0 108.917 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.653 ' C ' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -53.89 -40.31 66.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.603 179.51 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -49.88 -48.73 51.23 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.929 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -61.67 -59.94 4.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.498 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.465 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 2.2 mm? -45.27 -24.24 0.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.887 0.375 . . . . 0.0 110.017 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HD3' ' ND1' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -82.64 -42.24 18.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.792 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.6 -24.29 53.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.474 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 84.1 p -84.92 -2.95 58.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.344 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.7 m120 60.73 26.84 16.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.101 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.97 -24.03 31.85 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 121.027 -0.606 . . . . 0.0 111.75 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.16 102.62 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.697 -0.401 . . . . 0.0 109.947 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.685 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.8 OUTLIER -58.77 -57.41 11.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.873 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.647 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 25.8 m -41.2 -61.28 1.04 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.197 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.609 ' O ' HD12 ' A' ' 57' ' ' LEU . 72.3 mt-30 -50.58 -55.99 13.78 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.618 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.21 -54.03 3.02 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.951 ' O ' HG22 ' A' ' 59' ' ' THR . 23.4 t -45.57 -59.51 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.221 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.1 t -45.38 -49.24 13.24 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.101 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.609 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.5 mp -63.54 -27.62 69.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.811 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.929 HD21 ' HB2' ' A' ' 43' ' ' ALA . 89.4 mt -91.49 -9.48 44.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.704 -178.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.323 -0.547 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.41 -179.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.9 t0 . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.724 0.297 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.063 HD12 ' N ' ' A' ' 103' ' ' GLN . 3.9 pp -78.85 -32.71 46.16 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.085 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 1.063 ' N ' HD12 ' A' ' 102' ' ' LEU . 2.1 tt0 -65.3 -38.86 91.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.761 0.791 . . . . 0.0 109.733 -178.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.79 -49.92 12.19 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.93 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.435 0.636 . . . . 0.0 109.399 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.666 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -63.46 -43.43 98.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.975 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.83 80.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.186 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.92 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.58 -20.71 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.183 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.573 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.321 -0.664 0 CA-C-O 121.57 0.7 . . . . 0.0 109.143 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 . . . . . 0 C--O 1.234 0.256 0 CA-C-O 121.186 0.517 . . . . 0.0 109.607 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.796 HD13 ' HB3' ' A' ' 40' ' ' LEU . 5.1 mt -44.76 -59.32 2.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.362 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -69.32 -20.49 63.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.095 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.97 -21.36 40.39 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.788 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.498 HG21 HG11 ' A' ' 55' ' ' VAL . 30.8 mt -98.5 -50.76 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.387 0.613 . . . . 0.0 111.491 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.461 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -85.6 -37.21 19.8 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.492 -178.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.95 36.11 37.1 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.85 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -97.15 154.8 3.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.973 0.416 . . . . 0.0 111.203 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -121.65 23.5 10.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.044 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.85 ' H ' HG22 ' A' ' 34' ' ' ILE . 2.4 t70 -121.98 73.73 36.36 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.366 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.574 ' HA ' HD12 ' A' ' 40' ' ' LEU . 56.2 Cg_exo -36.99 -21.14 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.954 2.436 . . . . 0.0 112.37 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 36' ' ' ASP . 9.3 m -68.57 -54.27 17.68 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.841 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.853 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -75.5 -26.57 58.25 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.796 ' HB3' HD13 ' A' ' 28' ' ' LEU . 10.6 mt -61.31 -60.29 3.97 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.475 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -52.6 -50.75 62.43 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.754 179.361 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 41' ' ' HIS . 25.1 tt0 -40.33 -47.28 2.49 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -60.4 -49.63 76.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.066 178.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.769 ' CD2' HD11 ' A' ' 28' ' ' LEU . 1.0 OUTLIER -58.01 -25.22 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.437 179.671 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 41' ' ' HIS . 11.3 mmmt -79.07 -38.98 35.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.94 0.4 . . . . 0.0 110.433 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.6 -26.62 41.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.106 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.487 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 1.9 p -88.32 10.36 20.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.262 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.0 OUTLIER 49.88 30.78 4.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.723 0.297 . . . . 0.0 110.888 179.624 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.51 -23.42 35.15 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.437 ' O ' ' OG ' ' A' ' 47' ' ' SER . 29.6 t0 -63.03 96.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.029 0.442 . . . . 0.0 110.172 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.62 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.0 OUTLIER -56.35 -52.73 48.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.572 -178.973 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.62 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.4 m -50.82 -46.11 59.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.052 0.453 . . . . 0.0 110.929 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.605 ' O ' HD12 ' A' ' 57' ' ' LEU . 9.2 mm-40 -65.86 -53.56 38.2 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.45 -54.56 3.07 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.824 ' O ' HG22 ' A' ' 59' ' ' THR . 42.6 t -46.62 -57.17 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.757 177.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -49.39 -45.97 46.73 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.993 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.9 mp -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.853 HD22 ' CE2' ' A' ' 39' ' ' PHE . 79.8 mt -86.16 -23.95 26.36 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.899 -178.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.824 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.312 -1.048 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.104 -178.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.1 t70 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.792 0.33 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.02 HD12 ' N ' ' A' ' 103' ' ' GLN . 3.6 pp -76.74 -31.12 56.91 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.61 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 1.02 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -64.1 -39.72 94.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.783 0.801 . . . . 0.0 109.486 -178.925 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.55 -56.39 4.75 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.209 -1.36 . . . . 0.0 110.438 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.47 39.14 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.661 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -50.46 -65.84 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.317 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.02 15.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.55 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.23 -28.68 69.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.666 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.59 -16.65 18.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.043 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.678 HD13 ' O ' ' A' ' 110' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.32 -0.705 0 CA-C-O 121.552 0.691 . . . . 0.0 109.659 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' GLU . 24.3 mm-40 . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.98 0.419 . . . . 0.0 109.996 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.918 HD22 ' CD2' ' A' ' 44' ' ' LEU . 10.3 tp -46.6 -51.66 15.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.8 179.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttt180 -63.78 -21.4 66.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.8 tt0 -84.63 -21.91 30.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.579 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.539 HG21 HG11 ' A' ' 55' ' ' VAL . 44.3 mt -94.35 -50.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.493 0.663 . . . . 0.0 111.311 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.517 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.5 p -85.52 -37.83 19.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.397 -178.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.36 36.32 17.67 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.654 HG21 ' CD1' ' A' ' 39' ' ' PHE . 1.1 mm -97.57 143.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.736 0.303 . . . . 0.0 110.351 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -114.89 23.38 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.863 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.645 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -113.83 73.19 2.21 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.338 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -35.11 -24.21 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.938 2.425 . . . . 0.0 112.503 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.2 OUTLIER -71.4 -52.31 19.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.797 179.783 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 1.107 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.19 -28.38 64.18 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.916 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.772 HD23 HD23 ' A' ' 28' ' ' LEU . 1.2 mp -70.3 -48.35 57.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -62.18 -27.25 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.228 178.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -65.19 -48.38 73.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.885 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -62.2 -47.46 84.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.918 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -55.64 -42.58 75.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.189 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.453 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 5.0 tmtt? -74.44 -27.19 60.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.763 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.453 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -79.2 -24.15 43.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.084 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 0.4 OUTLIER -96.2 17.01 16.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.162 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 61.95 22.13 12.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.195 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.78 -23.53 33.55 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -62.96 124.03 20.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.738 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.1 tt -74.72 -55.49 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.077 -179.032 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.632 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.0 m -43.46 -54.19 4.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 0.0 110.169 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.589 ' O ' HD12 ' A' ' 57' ' ' LEU . 79.6 mt-30 -57.73 -54.52 45.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.469 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -40.37 -51.18 2.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.738 HG23 ' O ' ' A' ' 51' ' ' ILE . 18.1 t -50.38 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.024 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.0 t -41.94 -48.31 4.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.286 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.589 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.6 mp -63.09 -29.82 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.934 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.107 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 37.7 mt -89.93 -11.19 42.46 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -177.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.717 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.324 -0.536 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.832 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.239 0.543 0 CA-C-O 120.753 0.311 . . . . 0.0 111.785 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 1.044 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.19 -17.24 46.88 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.717 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.886 ' N ' HD22 ' A' ' 102' ' ' LEU . 1.0 OUTLIER -71.46 -37.16 71.38 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.697 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.84 -49.49 20.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.159 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.46 76.45 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.713 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.5 mm -53.96 -48.17 63.86 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.986 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.12 -34.49 73.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.049 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 tp -69.64 -22.7 63.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.11 -18.93 13.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 28.5 tp . . . . . 0 C--N 1.319 -0.736 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.206 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.679 ' OE1' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.786 0.327 . . . . 0.0 110.494 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.719 HD22 HD21 ' A' ' 44' ' ' LEU . 1.1 mt -51.84 -51.65 55.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.013 0.435 . . . . 0.0 111.072 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -22.56 46.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.552 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.35 -32.07 22.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.463 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.587 HG21 HG11 ' A' ' 55' ' ' VAL . 62.8 mt -78.9 -55.86 8.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.536 0.684 . . . . 0.0 110.943 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.529 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -78.09 -37.32 46.7 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.762 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.9 36.75 12.68 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -179.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.846 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -98.1 149.43 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.957 0.408 . . . . 0.0 110.851 -179.1 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -119.56 23.37 11.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.155 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.846 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -120.03 69.04 13.47 Favored Pre-proline 0 N--CA 1.453 -0.325 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.982 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -35.51 -20.45 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.864 2.376 . . . . 0.0 112.044 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.671 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.1 OUTLIER -74.76 -53.26 9.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.438 -179.328 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 1.081 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.78 -24.39 63.5 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.72 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.511 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 2.2 mt -67.47 -59.42 3.39 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.749 ' CE1' ' NZ ' ' A' ' 45' ' ' LYS . 1.2 t-80 -53.91 -26.39 24.87 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.814 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -64.95 -47.55 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 1.002 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -64.57 -46.39 82.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.66 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.719 HD21 HD22 ' A' ' 28' ' ' LEU . 4.6 mm? -56.14 -36.86 68.73 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.749 ' NZ ' ' CE1' ' A' ' 41' ' ' HIS . 25.9 mttp -68.93 -46.66 67.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.734 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.6 -22.12 64.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.918 0.39 . . . . 0.0 110.708 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.523 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 62.4 p -90.57 17.6 7.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.489 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.531 ' ND2' ' OD2' ' A' ' 50' ' ' ASP . 0.6 OUTLIER 48.57 30.27 2.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.0 -23.5 35.44 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.531 ' OD2' ' ND2' ' A' ' 48' ' ' ASN . 89.9 m-20 -58.26 115.44 2.95 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.138 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.706 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -69.27 -58.36 5.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.898 -179.255 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.601 ' N ' HG22 ' A' ' 51' ' ' ILE . 22.5 m -45.51 -57.15 4.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.012 0.434 . . . . 0.0 110.575 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.676 ' O ' HD12 ' A' ' 57' ' ' LEU . 75.1 mm-40 -51.51 -59.09 4.64 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.609 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.547 ' HA ' HD13 ' A' ' 57' ' ' LEU . . . -39.03 -54.76 1.66 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.478 0.656 . . . . 0.0 109.338 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.722 ' O ' HG22 ' A' ' 59' ' ' THR . 41.2 t -45.18 -59.19 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.48 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 53' ' ' GLN . 5.0 t -43.93 -49.69 8.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.642 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.2 mp -60.23 -30.31 69.32 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.249 0.547 . . . . 0.0 110.439 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 1.081 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 41.4 mt -88.07 -14.53 38.66 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.082 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.545 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.351 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.8 0.333 . . . . 0.0 110.107 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.846 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.21 -23.48 30.47 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.871 179.267 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.577 ' N ' HD22 ' A' ' 102' ' ' LEU . 1.1 mt-30 -67.94 -38.4 82.78 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 118.985 -1.086 . . . . 0.0 108.953 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.74 -51.98 9.03 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.689 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.62 -44.44 85.52 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.425 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -64.47 -43.87 96.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.038 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.27 -53.14 53.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.978 0.418 . . . . 0.0 110.793 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.74 HD23 ' O ' ' A' ' 108' ' ' LEU . 2.7 tt -54.77 -43.54 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.751 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.61 -19.85 32.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.47 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.584 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 3.7 tt . . . . . 0 C--N 1.321 -0.657 0 CA-C-O 121.103 0.478 . . . . 0.0 109.787 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.1 ptt? . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.812 HG23 ' N ' ' A' ' 3' ' ' ALA . 12.6 t -118.04 -138.83 0.36 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.586 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.812 ' N ' HG23 ' A' ' 2' ' ' THR . . . -93.17 176.15 6.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.545 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.747 ' C ' HD13 ' A' ' 5' ' ' LEU . 7.7 pt-20 -101.38 154.58 18.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.588 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.985 ' N ' HD13 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -134.8 175.16 9.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.561 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.522 ' O ' ' O ' ' A' ' 5' ' ' LEU . 5.4 tp60 39.84 98.68 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.468 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -80.27 -4.98 55.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.661 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.35 -19.43 39.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.142 0.496 . . . . 0.0 110.216 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.413 ' O ' ' O ' ' A' ' 10' ' ' ALA . 22.8 m-20 -63.27 -20.09 65.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.224 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.413 ' O ' ' O ' ' A' ' 9' ' ' ASP . . . 42.96 -167.9 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.75 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -132.05 -42.48 0.99 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.513 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -158.83 -172.79 26.39 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.43 163.39 1.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.719 0.295 . . . . 0.0 110.613 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -157.45 59.54 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.577 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -124.54 -167.03 1.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.561 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.91 25.36 4.84 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.648 ' ND1' ' N ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -93.55 -22.16 18.99 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.626 179.905 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.648 ' N ' ' ND1' ' A' ' 17' ' ' HIS . . . 21.73 81.09 0.01 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.525 ' C ' ' O ' ' A' ' 18' ' ' GLY . 0.1 OUTLIER 28.84 85.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 110.669 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.576 ' OG ' ' O ' ' A' ' 17' ' ' HIS . 2.5 p 171.62 69.16 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.639 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -77.23 172.9 12.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.495 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.464 ' O ' ' CB ' ' A' ' 26' ' ' ASN . 1.9 pt20 -81.15 -12.43 59.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 3.6 ptt? -67.15 -31.15 71.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.949 0.404 . . . . 0.0 111.211 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.432 ' HB2' HD23 ' A' ' 25' ' ' LEU . 19.0 mt -61.93 -63.95 1.09 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.083 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.799 HD23 ' H ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -70.53 -32.95 70.6 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.12 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.584 ' C ' HD22 ' A' ' 26' ' ' ASN . 0.6 OUTLIER -59.26 -59.87 4.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.656 0.741 . . . . 0.0 109.684 179.765 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HB2' HD11 ' A' ' 51' ' ' ILE . 14.0 mm-40 -54.48 -53.37 55.14 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.981 -1.009 . . . . 0.0 108.985 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.501 HD23 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -45.62 -51.62 11.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.065 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 29' ' ' ARG . 1.7 mtp180 -64.06 -22.23 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.617 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.535 ' OE2' ' ND2' ' A' ' 26' ' ' ASN . 45.0 mt-10 -85.46 -20.2 30.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.847 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.7 HD13 HG21 ' A' ' 55' ' ' VAL . 16.6 mt -93.83 -50.84 11.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.575 0.702 . . . . 0.0 111.396 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.531 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 1.6 p -92.69 -38.0 12.08 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.143 -177.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.42 35.97 35.58 Favored Glycine 0 CA--C 1.522 0.5 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.697 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -90.81 150.5 3.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.054 0.454 . . . . 0.0 111.057 -179.113 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.423 ' H ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -114.38 23.74 12.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.988 -179.113 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.697 ' H ' HG22 ' A' ' 34' ' ' ILE . 40.1 t0 -120.64 74.37 24.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.156 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -36.07 -25.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.929 2.419 . . . . 0.0 112.177 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -73.13 -51.62 17.28 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.09 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.925 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.31 -27.44 64.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -69.45 -55.94 8.84 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.311 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -58.14 -25.17 61.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.386 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -66.29 -49.1 68.23 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.915 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -58.14 -44.85 88.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.248 179.11 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.501 HD21 HD23 ' A' ' 28' ' ' LEU . 3.7 mm? -63.05 -34.0 76.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.011 0.434 . . . . 0.0 110.097 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 1.4 tmtm? -72.9 -30.8 64.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.033 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.454 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.42 -28.79 28.61 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.245 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.709 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 1.1 m -84.5 3.59 35.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.423 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 68.54 21.31 8.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.166 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.66 0.35 49.43 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.479 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.28 130.57 34.55 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.139 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.562 HG22 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -78.01 -52.2 16.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.512 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.562 ' N ' HG22 ' A' ' 51' ' ' ILE . 28.5 m -52.26 -53.2 46.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 111.268 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.487 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 mm-40 -59.39 -56.77 17.84 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.427 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.709 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -41.69 -57.31 2.34 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-O 122.193 0.997 . . . . 0.0 108.593 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.7 HG21 HD13 ' A' ' 31' ' ' ILE . 2.1 t -43.02 -57.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.454 -1.703 . . . . 0.0 108.324 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.453 ' N ' HG12 ' A' ' 55' ' ' VAL . 2.7 t -46.73 -52.94 12.85 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.164 178.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 13.7 mt -50.18 -38.97 42.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.219 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.925 HD22 ' CE2' ' A' ' 39' ' ' PHE . 21.0 mt -81.03 -53.81 6.1 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.123 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.675 HG23 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -56.81 -22.15 34.19 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.557 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 3.0 t70 -97.88 67.22 1.95 Allowed 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.081 178.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.557 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 4.2 tt0 84.25 89.09 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -178.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.453 ' HG3' ' H ' ' A' ' 63' ' ' VAL . 0.9 OUTLIER -107.34 -73.8 0.68 Allowed 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.336 0.589 . . . . 0.0 111.163 -178.59 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.453 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 22.7 t -102.36 -104.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.902 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt 61.22 -122.44 0.84 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.391 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.503 ' CA ' ' OE1' ' A' ' 65' ' ' GLU . 0.2 OUTLIER 174.68 81.67 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.957 0.408 . . . . 0.0 110.875 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.604 ' O ' ' C ' ' A' ' 67' ' ' SER . 71.8 Cg_endo -81.95 -102.54 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 122.883 2.389 . . . . 0.0 111.761 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.604 ' C ' ' O ' ' A' ' 66' ' ' PRO . 22.1 m 6.88 -85.94 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.324 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.586 ' O ' ' O ' ' A' ' 67' ' ' SER . 15.2 mt-30 -44.95 -176.19 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.38 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.615 ' O ' ' O ' ' A' ' 70' ' ' THR . 3.0 m-20 -89.31 -53.57 4.5 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.261 0.553 . . . . 0.0 110.768 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.615 ' O ' ' O ' ' A' ' 69' ' ' ASP . 72.4 p 30.73 -158.91 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.675 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.969 HG12 ' H ' ' A' ' 72' ' ' ALA . 2.5 t 28.86 -153.45 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.698 0.761 . . . . 0.0 111.067 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.969 ' H ' HG12 ' A' ' 71' ' ' VAL . . . -114.41 -28.36 7.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.212 178.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 72' ' ' ALA . 0.2 OUTLIER -49.78 -170.19 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.108 -1.406 . . . . 0.0 110.869 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.416 ' H ' HG22 ' A' ' 73' ' ' THR . 4.4 pt-20 -104.82 149.03 37.05 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.166 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.13 154.78 57.23 Favored 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.623 2.215 . . . . 0.0 112.117 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.0 m -137.42 85.08 2.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.541 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -107.52 -4.42 18.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.485 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.57 ' O ' ' O ' ' A' ' 79' ' ' GLU . 2.9 t -130.67 -126.45 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.642 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.57 ' O ' ' O ' ' A' ' 78' ' ' VAL . 11.7 mt-10 -26.37 147.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.901 0.381 . . . . 0.0 110.66 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 168.23 -3.59 0.04 OUTLIER Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.548 ' O ' ' O ' ' A' ' 82' ' ' ALA . 0.7 OUTLIER -94.57 -169.05 1.95 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.742 0.306 . . . . 0.0 110.584 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.548 ' O ' ' O ' ' A' ' 81' ' ' SER . . . -40.59 172.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.872 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -177.82 -144.83 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.437 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -66.07 -4.03 6.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.401 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.681 ' O ' ' N ' ' A' ' 87' ' ' VAL . 15.3 tttp -70.79 -80.15 0.06 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.614 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.605 ' O ' HG23 ' A' ' 87' ' ' VAL . 0.8 OUTLIER -31.88 -27.73 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.63 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.681 ' N ' ' O ' ' A' ' 85' ' ' LYS . 77.3 t -161.84 128.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.685 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.416 ' O ' ' O ' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -90.55 -29.5 17.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.525 0.678 . . . . 0.0 109.536 179.102 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.416 ' O ' ' O ' ' A' ' 88' ' ' LEU . . . 44.9 -172.16 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.728 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.13 -156.61 0.57 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.43 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 91' ' ' VAL . 4.1 t 65.73 23.31 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.74 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.417 ' C ' ' O ' ' A' ' 91' ' ' VAL . 3.9 pt -39.02 131.71 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.494 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -168.64 112.63 0.58 Allowed 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.28 0.562 . . . . 0.0 110.195 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.66 ' O ' ' ND2' ' A' ' 98' ' ' ASN . 0.2 OUTLIER -131.53 -52.29 1.0 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.832 -179.059 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.485 ' H ' ' HG ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -76.38 -162.56 0.25 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.24 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.529 ' CG ' ' H ' ' A' ' 97' ' ' ASP . 31.1 t-80 53.88 -125.92 2.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.331 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.529 ' H ' ' CG ' ' A' ' 96' ' ' HIS . 21.3 p-10 -97.05 96.44 8.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.222 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.695 ' O ' ' N ' ' A' ' 100' ' ' ASP . 0.2 OUTLIER -109.32 150.45 27.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.887 -179.623 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.437 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER 40.19 11.22 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.23 179.699 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.695 ' N ' ' O ' ' A' ' 98' ' ' ASN . 3.4 t0 -44.64 -20.36 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.75 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.437 ' N ' ' O ' ' A' ' 99' ' ' LYS . 0.7 OUTLIER -58.71 -60.24 4.13 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.879 -179.552 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.697 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.1 pp -82.11 -30.31 31.27 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.697 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.6 0.714 . . . . 0.0 109.881 -178.809 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.549 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -80.94 -48.48 12.24 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.232 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.78 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.693 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -65.63 -42.72 93.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.838 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.12 -48.2 68.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.966 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -38.56 83.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.66 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -20.7 25.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 111.461 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.557 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 23.1 tp -82.31 -26.07 33.37 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.537 0.684 . . . . 0.0 109.459 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 111' ' ' LEU . 1.0 OUTLIER -75.51 -17.9 59.97 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.074 -179.75 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -106.0 -21.08 13.23 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.989 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.563 ' O ' ' O ' ' A' ' 114' ' ' PRO . 0.1 OUTLIER -106.69 171.2 4.93 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.8 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PRO . . . . . 0.563 ' O ' ' O ' ' A' ' 113' ' ' SER . 50.1 Cg_exo -49.11 -128.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.964 2.442 . . . . 0.0 112.34 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -121.28 -93.64 0.52 Allowed 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.269 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.64 145.34 13.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.584 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -130.75 -2.4 4.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.638 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 41.69 -138.58 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.533 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -73.78 -42.39 61.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.619 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.714 0 CA-C-O 118.026 -1.43 . . . . 0.0 110.875 -179.994 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.513 ' O ' ' C ' ' A' ' 2' ' ' THR . 8.8 tpt . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.513 ' C ' ' O ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -29.29 129.86 0.08 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.493 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.6 -107.43 0.34 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.731 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 56.7 tt0 -109.56 -32.25 7.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.968 0.413 . . . . 0.0 110.977 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.02 ' H ' HD13 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -68.31 157.26 36.01 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.528 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.442 ' HG2' ' H ' ' A' ' 8' ' ' ASP . 32.1 tt0 179.85 154.7 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.471 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.42 -15.66 14.96 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.922 0.392 . . . . 0.0 110.635 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.442 ' H ' ' HG2' ' A' ' 6' ' ' GLN . 12.6 t0 -84.36 -63.17 1.39 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.301 0.572 . . . . 0.0 110.332 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.579 ' O ' ' O ' ' A' ' 10' ' ' ALA . 2.4 m-20 -62.32 -21.84 65.59 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.228 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.579 ' O ' ' O ' ' A' ' 9' ' ' ASP . . . -39.36 172.01 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.672 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.04 118.2 30.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.701 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.484 ' O ' ' C ' ' A' ' 13' ' ' ALA . . . -120.83 78.65 0.32 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.484 ' C ' ' O ' ' A' ' 12' ' ' GLY . . . 33.14 -120.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.819 0.342 . . . . 0.0 110.478 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -115.73 64.01 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.375 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.569 ' CG ' ' H ' ' A' ' 16' ' ' GLY . 38.6 t0 66.94 -144.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.503 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.569 ' H ' ' CG ' ' A' ' 15' ' ' ASP . . . -157.89 -177.06 30.64 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -95.73 -80.21 0.43 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.778 0.323 . . . . 0.0 110.574 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.47 -5.76 3.23 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.1 m -133.54 -150.78 0.42 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.806 0.336 . . . . 0.0 110.403 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.5 p -143.34 94.22 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.337 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.637 ' O ' ' N ' ' A' ' 23' ' ' MET . 3.5 m -128.59 -161.62 1.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.882 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.502 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.8 pm0 -42.76 -12.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.667 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.637 ' N ' ' O ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -56.62 -57.89 10.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.179 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.639 ' O ' ' CD2' ' A' ' 28' ' ' LEU . 10.4 mt -52.28 -63.17 1.23 Allowed 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.411 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.089 HD22 ' H ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -51.23 -53.28 36.7 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.926 -179.203 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -56.16 -47.53 78.06 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.559 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.406 ' HB3' HD13 ' A' ' 51' ' ' ILE . 0.5 OUTLIER -56.91 -63.55 1.17 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.763 -178.818 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.838 HD22 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -53.26 -51.65 61.57 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.302 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -23.01 63.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.631 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.29 -44.12 16.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.546 HG21 HG11 ' A' ' 55' ' ' VAL . 63.1 mt -69.81 -54.78 17.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.416 0.627 . . . . 0.0 111.438 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.511 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 4.7 p -76.13 -36.59 58.75 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.553 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.2 36.15 60.24 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.957 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.7 mm -90.62 151.29 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.173 0.511 . . . . 0.0 111.703 -178.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -119.33 23.26 11.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.707 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.957 ' H ' HG22 ' A' ' 34' ' ' ILE . 46.5 t0 -120.37 69.92 15.85 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.212 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HA ' HD12 ' A' ' 40' ' ' LEU . 83.1 Cg_exo -36.94 -21.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.753 2.302 . . . . 0.0 111.707 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -75.41 -52.74 10.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.356 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.762 ' CE1' HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.22 -26.23 64.71 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.587 HD22 HD12 ' A' ' 28' ' ' LEU . 14.1 mt -66.33 -55.93 13.6 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -50.85 -37.18 41.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.598 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -58.22 -45.37 87.81 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -58.26 -54.11 50.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.027 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.838 HD21 HD22 ' A' ' 28' ' ' LEU . 3.8 mm? -62.64 -20.22 64.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.278 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -79.01 -54.13 6.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.973 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.26 -29.48 69.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 4.0 p -76.15 -16.75 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m120 68.24 33.37 4.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.498 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.48 -20.97 42.63 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 47' ' ' SER . 36.0 m-20 -68.53 118.46 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.832 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.1 OUTLIER -74.18 -53.17 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.52 -179.726 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.611 ' N ' HG22 ' A' ' 51' ' ' ILE . 39.3 m -45.76 -55.52 6.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.344 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.35 -57.35 11.6 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.674 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.86 -47.65 4.26 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 109.785 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.985 ' O ' HG22 ' A' ' 59' ' ' THR . 24.6 t -53.95 -59.75 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.817 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -54.59 -44.82 73.37 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.806 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 54' ' ' ALA . 10.3 mt -58.09 -36.23 72.56 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.485 0.66 . . . . 0.0 110.893 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.762 HD23 ' CE1' ' A' ' 39' ' ' PHE . 7.2 mp -84.35 -40.23 18.14 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.787 -1.097 . . . . 0.0 113.268 -177.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.985 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.5 t -97.09 8.72 43.91 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.84 -178.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.582 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 0.4 OUTLIER -57.5 17.31 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.965 -0.294 . . . . 0.0 110.812 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.734 ' H ' ' C ' ' A' ' 59' ' ' THR . 5.2 tt0 87.97 52.88 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 120.799 0.333 . . . . 0.0 110.879 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.672 ' O ' ' N ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -124.44 -63.08 1.21 Allowed 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 121.126 0.488 . . . . 0.0 111.372 -179.744 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.451 ' H ' ' HG2' ' A' ' 62' ' ' ARG . 2.8 t -40.2 -13.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.129 -179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.672 ' N ' ' O ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -137.93 155.85 48.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.986 0.422 . . . . 0.0 110.577 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.609 ' O ' ' O ' ' A' ' 66' ' ' PRO . 53.8 mp0 -131.28 133.94 25.14 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.205 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.609 ' O ' ' O ' ' A' ' 65' ' ' GLU . 52.5 Cg_exo -46.95 -130.15 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.451 2.1 . . . . 0.0 112.643 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.479 ' O ' ' C ' ' A' ' 68' ' ' GLN . 11.0 p 42.97 32.52 0.42 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.361 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.479 ' C ' ' O ' ' A' ' 67' ' ' SER . 2.9 mm-40 -33.69 148.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.684 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -80.83 -29.28 35.95 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.499 0.666 . . . . 0.0 110.461 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.7 p -119.5 131.92 55.67 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.289 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.1 m -144.96 129.9 13.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.654 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.582 ' O ' ' OG1' ' A' ' 73' ' ' THR . . . -49.74 -36.34 25.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.235 0.54 . . . . 0.0 110.306 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.582 ' OG1' ' O ' ' A' ' 72' ' ' ALA . 84.9 m -176.52 -67.14 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.564 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.404 ' C ' ' O ' ' A' ' 73' ' ' THR . 0.9 OUTLIER -36.79 102.73 0.24 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.265 -179.731 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -82.5 163.74 16.74 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.653 2.235 . . . . 0.0 111.754 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.43 -157.74 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.904 0.383 . . . . 0.0 110.632 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.543 ' N ' ' CD ' ' A' ' 77' ' ' GLU . 22.0 mp0 -127.65 -101.37 0.35 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.757 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 1.032 HG22 ' H ' ' A' ' 79' ' ' GLU . 10.0 p -163.67 -146.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.346 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 1.032 ' H ' HG22 ' A' ' 78' ' ' VAL . 87.2 mt-10 -142.8 -76.23 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.769 0.318 . . . . 0.0 110.779 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -107.49 176.73 21.04 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.4 m -111.76 -174.26 2.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.827 0.346 . . . . 0.0 110.671 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -49.16 168.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.856 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -126.99 -153.94 0.6 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.545 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -100.25 13.59 33.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.611 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' ' 87' ' ' VAL . 0.0 OUTLIER -111.09 -157.98 0.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.484 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 62.96 -8.93 0.12 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.042 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.56 ' H ' ' C ' ' A' ' 85' ' ' LYS . 97.8 t -143.03 132.78 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.925 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.662 HD23 ' O ' ' A' ' 88' ' ' LEU . 1.3 tt -90.92 -31.53 16.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.62 0.724 . . . . 0.0 109.63 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.509 ' O ' ' O ' ' A' ' 88' ' ' LEU . . . 50.28 165.56 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.131 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.566 ' HA ' ' HZ3' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -111.43 -144.46 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.045 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.633 ' O ' HG22 ' A' ' 91' ' ' VAL . 14.2 p -128.14 6.03 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.906 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.414 ' O ' ' O ' ' A' ' 91' ' ' VAL . 17.3 pt -41.38 162.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.384 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -178.75 113.62 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.971 0.415 . . . . 0.0 110.59 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.915 HD12 ' N ' ' A' ' 95' ' ' THR . 4.2 pp -117.62 -50.38 2.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.673 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.915 ' N ' HD12 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -52.12 -148.18 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.558 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.656 ' H ' HG22 ' A' ' 95' ' ' THR . 61.7 m-70 -162.13 179.9 7.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.343 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.555 ' O ' ' O ' ' A' ' 98' ' ' ASN . 4.4 p-10 31.76 39.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.038 0.447 . . . . 0.0 110.172 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.555 ' O ' ' O ' ' A' ' 97' ' ' ASP . 46.5 m-80 -52.18 -122.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.925 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.444 ' CG ' ' H ' ' A' ' 100' ' ' ASP . 7.3 pttm -137.34 -110.93 0.18 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.282 0.563 . . . . 0.0 111.947 -178.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.579 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -61.29 -25.27 66.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.577 -178.951 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.81 -60.9 2.89 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.091 -179.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.083 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.95 -19.71 36.65 Favored 'General case' 0 C--O 1.216 -0.666 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.442 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.908 ' N ' HD22 ' A' ' 102' ' ' LEU . 2.6 mt-30 -67.77 -36.69 80.95 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.504 -0.879 . . . . 0.0 108.769 179.041 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.34 -52.36 8.21 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.516 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.57 -45.5 85.11 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.679 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.1 mm -62.73 -45.8 97.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.988 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.06 91.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.247 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.26 -40.53 94.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.843 0.354 . . . . 0.0 110.346 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -18.02 32.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.902 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 1.001 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.2 tm? -93.73 -12.05 30.07 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.62 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.68 -21.11 66.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.452 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -68.37 -79.94 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.533 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.79 102.51 35.41 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.509 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -76.79 171.3 18.25 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 122.387 2.058 . . . . 0.0 111.92 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -159.74 -165.07 1.44 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.985 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.445 ' C ' ' H ' ' A' ' 118' ' ' ALA . 0.8 OUTLIER -134.52 -177.82 2.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.288 179.909 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.486 ' N ' ' CD ' ' A' ' 117' ' ' GLN . 3.7 mp0 -76.72 33.46 0.14 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.702 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.445 ' H ' ' C ' ' A' ' 116' ' ' ILE . . . 37.22 -138.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.659 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.536 ' C ' ' OD1' ' A' ' 119' ' ' ASP . 25.3 t0 -174.25 -74.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.571 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.696 0 CA-C-O 118.045 -1.42 . . . . 0.0 110.864 -179.973 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptm . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.1 m -67.32 -30.19 69.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.614 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 39.65 -139.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.623 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.06 -178.43 0.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.57 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.943 ' H ' HD22 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -85.16 158.33 20.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.487 ' C ' ' H ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER -78.28 -57.18 3.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.323 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 71.73 -14.85 0.48 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.487 ' H ' ' C ' ' A' ' 6' ' ' GLN . 0.8 OUTLIER -103.75 -19.56 14.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.385 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.598 ' O ' ' C ' ' A' ' 10' ' ' ALA . 1.6 m-20 -80.13 -41.03 26.2 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.472 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.598 ' C ' ' O ' ' A' ' 9' ' ' ASP . . . 13.9 -114.15 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.072 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.541 ' O ' ' C ' ' A' ' 12' ' ' GLY . . . -80.16 -113.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.171 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.541 ' C ' ' O ' ' A' ' 11' ' ' ALA . . . 26.66 56.77 0.09 OUTLIER Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' C ' ' A' ' 14' ' ' ALA . . . -143.65 -142.63 0.14 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 110.385 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' A' ' 13' ' ' ALA . . . -36.59 146.56 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.434 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -67.75 -138.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.588 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.78 179.15 21.38 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 62.4 m170 -107.27 -84.11 0.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.746 0.308 . . . . 0.0 110.359 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.57 ' O ' ' C ' ' A' ' 19' ' ' SER . . . 69.56 -151.18 50.48 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.294 -0.722 . . . . 0.0 111.294 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.57 ' C ' ' O ' ' A' ' 18' ' ' GLY . 0.7 OUTLIER -15.22 115.7 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.81 0.338 . . . . 0.0 111.396 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.58 93.43 2.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.545 ' H ' HD11 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -116.35 169.58 9.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.554 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -83.47 -19.03 36.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.048 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.3 ttm -60.34 -43.02 96.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.899 0.38 . . . . 0.0 111.82 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.564 ' HB3' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -54.17 -64.06 0.95 Allowed 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.2 -178.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -32.99 72.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.832 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -63.17 -59.09 5.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.149 0.499 . . . . 0.0 110.649 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -58.88 -61.29 2.74 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.489 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.637 ' HB3' HD23 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -45.49 -55.78 5.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.803 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -67.31 -20.94 65.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.61 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -80.75 -24.14 38.9 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.449 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.576 HG21 HG11 ' A' ' 55' ' ' VAL . 46.2 mt -95.8 -54.83 6.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.571 0.7 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.441 ' OG1' HG13 ' A' ' 34' ' ' ILE . 5.8 p -78.88 -37.92 38.94 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.78 -178.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.79 36.04 30.02 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.746 HD12 ' CZ ' ' A' ' 39' ' ' PHE . 1.1 mm -98.74 144.78 11.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.789 0.328 . . . . 0.0 110.964 -179.153 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.522 ' OE1' ' N ' ' A' ' 35' ' ' GLN . 3.3 mp0 -113.35 22.7 13.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.658 ' H ' HG22 ' A' ' 34' ' ' ILE . 1.5 m-20 -111.46 71.6 0.89 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.354 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' CG ' ' A' ' 41' ' ' HIS . 78.2 Cg_exo -35.31 -22.71 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.752 2.301 . . . . 0.0 111.92 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.638 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -74.06 -49.59 23.41 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.869 179.881 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.821 ' CE1' HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -73.92 -29.83 62.25 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.648 HD12 ' O ' ' A' ' 36' ' ' ASP . 1.7 mp -69.96 -49.81 48.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.462 -0.79 . . . . 0.0 108.87 177.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.442 ' CG ' ' O ' ' A' ' 37' ' ' PRO . 18.5 m170 -67.06 -24.02 65.93 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.464 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -68.17 -39.02 82.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.752 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -63.87 -50.12 70.06 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.963 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.597 HD21 HD12 ' A' ' 28' ' ' LEU . 81.7 mt -65.4 -24.38 67.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.942 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.8 -31.2 45.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.174 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.9 -35.6 26.01 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.928 0.394 . . . . 0.0 110.076 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.57 ' O ' ' OD1' ' A' ' 48' ' ' ASN . 72.3 p -84.28 12.55 6.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.705 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 47' ' ' SER . 24.0 p30 47.4 37.98 6.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.778 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.36 -24.0 32.42 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.244 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.09 104.46 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 117.267 0.534 . . . . 0.0 109.981 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.645 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.3 OUTLIER -60.77 -55.58 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.183 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.645 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.9 m -40.88 -57.55 1.93 Allowed 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.322 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 54' ' ' ALA . 8.6 mt-30 -51.18 -55.01 20.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.696 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.824 ' HA ' HD12 ' A' ' 57' ' ' LEU . . . -41.75 -44.63 3.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.46 0.648 . . . . 0.0 109.704 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.946 ' O ' HG22 ' A' ' 59' ' ' THR . 13.7 t -59.22 -59.6 3.61 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.75 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.567 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 22.3 t -52.95 -38.15 61.77 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.593 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 54' ' ' ALA . 8.7 mt -67.34 -40.56 85.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.264 0.554 . . . . 0.0 111.285 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.821 HD23 ' CE1' ' A' ' 39' ' ' PHE . 6.9 mp -80.37 -38.98 29.37 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.682 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.946 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.3 t -98.71 -10.94 22.46 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.756 -178.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.567 ' OD1' ' O ' ' A' ' 56' ' ' SER . 0.4 OUTLIER -34.82 -86.67 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.208 0.527 . . . . 0.0 109.85 179.445 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.557 ' H ' ' HD2' ' A' ' 62' ' ' ARG . 1.7 tt0 -152.87 61.44 0.79 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.948 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.697 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -129.56 -93.5 0.43 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.349 0.595 . . . . 0.0 111.092 -179.13 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.58 ' H ' ' CG ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -51.92 -86.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.585 -179.669 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.422 ' CB ' ' NZ ' ' A' ' 64' ' ' LYS . 0.6 OUTLIER 53.74 -177.75 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.396 179.73 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.66 ' OE1' ' N ' ' A' ' 65' ' ' GLU . 1.8 mp0 -73.03 148.35 89.03 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.504 ' O ' ' C ' ' A' ' 67' ' ' SER . 11.3 Cg_endo -56.37 -146.34 0.0 OUTLIER 'Trans proline' 0 C--N 1.302 -1.912 0 C-N-CA 122.424 2.083 . . . . 0.0 111.53 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.504 ' C ' ' O ' ' A' ' 66' ' ' PRO . 11.7 p 31.5 39.65 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.846 0.355 . . . . 0.0 110.622 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 66' ' ' PRO . 2.2 tt0 -172.06 13.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.323 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -76.81 -23.91 52.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.141 0.496 . . . . 0.0 110.855 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -153.86 134.47 13.62 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.521 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.91 149.18 33.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.573 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.602 ' O ' ' OG1' ' A' ' 73' ' ' THR . . . -103.61 -40.19 6.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.218 0.533 . . . . 0.0 109.98 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.602 ' OG1' ' O ' ' A' ' 72' ' ' ALA . 99.6 m -176.67 -37.67 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.669 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.612 ' O ' ' O ' ' A' ' 75' ' ' PRO . 30.2 mt-10 -82.15 149.62 62.81 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.844 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.612 ' O ' ' O ' ' A' ' 74' ' ' GLU . 42.4 Cg_exo -48.29 -138.91 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.719 2.279 . . . . 0.0 112.592 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.4 p -76.96 175.32 9.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.412 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -46.07 -77.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.397 0.618 . . . . 0.0 110.368 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 1.074 HG22 ' H ' ' A' ' 79' ' ' GLU . 9.9 p -113.68 -147.83 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.383 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 1.074 ' H ' HG22 ' A' ' 78' ' ' VAL . 0.0 OUTLIER -98.6 -59.85 1.66 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.811 0.338 . . . . 0.0 110.641 -179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 124.98 -36.97 2.68 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 21.4 m -133.62 179.38 6.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.771 0.319 . . . . 0.0 110.574 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -46.36 171.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.745 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -93.33 160.19 14.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.7 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.6 m-20 -120.59 14.69 11.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.481 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 166.86 12.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.309 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -60.65 -17.65 48.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.103 0.477 . . . . 0.0 110.271 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 2.7 t -145.6 152.94 13.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.135 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.986 HD23 ' O ' ' A' ' 88' ' ' LEU . 6.1 tt -71.31 -26.74 62.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.138 0.494 . . . . 0.0 110.471 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.749 ' HB3' ' O ' ' A' ' 88' ' ' LEU . . . 84.01 -7.92 1.03 Allowed 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.052 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.88 ' O ' HD22 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -167.58 113.72 0.73 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.402 179.383 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.636 HG13 ' N ' ' A' ' 92' ' ' ILE . 5.4 p 179.26 -54.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 1.018 HG22 ' H ' ' A' ' 93' ' ' ASP . 19.5 mt 56.46 -170.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.536 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 1.018 ' H ' HG22 ' A' ' 92' ' ' ILE . 26.7 t0 73.1 96.75 0.07 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.205 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.095 HD23 ' H ' ' A' ' 95' ' ' THR . 1.1 pt? -137.41 -49.05 0.59 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.403 0.62 . . . . 0.0 110.789 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . 1.095 ' H ' HD23 ' A' ' 94' ' ' LEU . 3.0 t -68.8 115.07 7.72 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.363 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -123.77 -166.98 1.55 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.645 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.92 -175.12 5.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.45 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -81.13 -20.26 41.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.985 0.421 . . . . 0.0 110.638 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.477 ' C ' ' N ' ' A' ' 101' ' ' ASP . 0.3 OUTLIER -94.46 10.19 35.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.564 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.536 ' C ' ' OD1' ' A' ' 100' ' ' ASP . 34.4 p30 -48.3 -14.15 0.05 Allowed 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.027 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.535 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 0.1 OUTLIER -59.81 -61.57 2.52 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.056 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.117 HD23 ' N ' ' A' ' 103' ' ' GLN . 0.5 OUTLIER -83.23 -28.83 28.94 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.486 179.458 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 1.117 ' N ' HD23 ' A' ' 102' ' ' LEU . 1.1 tt0 -63.26 -39.03 93.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.912 0.863 . . . . 0.0 109.364 -179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' A' ' 100' ' ' ASP . . . -80.31 -54.64 5.54 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.141 -1.39 . . . . 0.0 111.169 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.41 -44.34 76.13 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.351 0.596 . . . . 0.0 109.471 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.668 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -67.37 -41.86 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.364 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.51 89.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -38.97 89.6 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.178 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.65 -18.04 34.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.098 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 1.028 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? -97.02 -11.41 24.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.791 -179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.644 ' C ' ' H ' ' A' ' 113' ' ' SER . 20.2 mt -121.81 -170.43 2.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.349 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 63.13 -23.01 0.06 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.765 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.644 ' H ' ' C ' ' A' ' 111' ' ' LEU . 13.9 m -136.94 136.66 21.49 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.841 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -76.68 -175.01 2.38 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 C-N-CA 122.525 2.15 . . . . 0.0 111.907 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.535 ' H ' ' CD ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -111.82 -165.69 1.01 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.774 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 1.011 HG22 ' H ' ' A' ' 117' ' ' GLN . 8.9 mt -144.06 -153.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.232 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 1.011 ' H ' HG22 ' A' ' 116' ' ' ILE . 0.2 OUTLIER -68.08 81.8 0.22 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.416 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -55.91 -166.87 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.466 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.9 -78.37 0.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.579 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.801 0 CA-C-O 117.972 -1.46 . . . . 0.0 110.995 179.921 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.1 m -157.22 135.28 11.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.663 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.59 -176.63 4.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.27 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.463 ' O ' ' O ' ' A' ' 5' ' ' LEU . 22.4 tp10 56.8 -120.19 1.37 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.279 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.463 ' O ' ' O ' ' A' ' 4' ' ' GLU . 0.2 OUTLIER -48.67 -178.92 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.199 179.699 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.496 ' C ' ' H ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER -130.51 -127.37 0.2 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.806 0.336 . . . . 0.0 110.744 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 74.39 -19.1 0.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.15 0.5 . . . . 0.0 110.227 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.496 ' H ' ' C ' ' A' ' 6' ' ' GLN . 0.3 OUTLIER -110.54 -20.17 12.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.342 179.503 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -43.38 -20.67 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.458 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.482 ' N ' ' O ' ' A' ' 8' ' ' ASP . . . -58.51 -8.56 1.27 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.59 -177.58 6.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.461 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 116.23 165.34 14.17 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -139.37 170.32 16.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.877 0.37 . . . . 0.0 110.632 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.66 27.4 1.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.577 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.661 ' OD1' ' N ' ' A' ' 16' ' ' GLY . 13.1 t70 42.77 -120.83 0.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.803 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.661 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 95.73 -128.34 9.49 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.534 ' N ' ' ND1' ' A' ' 17' ' ' HIS . 0.9 OUTLIER -112.91 101.18 9.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.759 0.314 . . . . 0.0 110.542 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -88.76 -172.3 46.39 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.99 9.66 6.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.755 0.312 . . . . 0.0 110.638 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.9 p -112.88 175.67 5.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.328 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 m -134.56 100.74 4.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.867 0.365 . . . . 0.0 110.754 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.625 ' O ' HD13 ' A' ' 25' ' ' LEU . 83.9 mt-30 -82.36 -14.1 55.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.559 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.649 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -69.09 -21.63 64.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.488 -179.138 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.597 ' O ' ' CD2' ' A' ' 28' ' ' LEU . 71.1 mt -65.46 -66.24 0.57 Allowed 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.831 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.873 HD22 ' C ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -67.64 -34.85 77.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.296 179.819 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.812 ' H ' HD13 ' A' ' 25' ' ' LEU . 16.8 t-20 -65.77 -41.8 91.63 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.299 0.571 . . . . 0.0 110.082 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.649 ' CG ' ' O ' ' A' ' 23' ' ' MET . 30.2 mm-40 -61.49 -55.52 30.26 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.621 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.751 ' HB2' HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -52.6 -55.08 24.86 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.594 -179.386 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.426 ' CD ' ' C ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -63.54 -21.63 66.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.352 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -87.64 -20.32 26.5 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.462 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.0 mt -97.43 -53.53 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-O 121.529 0.68 . . . . 0.0 111.085 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.516 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.1 p -77.85 -36.65 49.69 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.95 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.2 35.78 52.33 Favored Glycine 0 CA--C 1.519 0.288 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.919 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.8 mm -92.72 155.64 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.118 0.485 . . . . 0.0 111.68 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.43 ' N ' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -118.9 23.2 11.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.41 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.919 ' H ' HG22 ' A' ' 34' ' ' ILE . 4.5 m-20 -125.27 75.94 68.3 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.979 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.559 ' HA ' HD12 ' A' ' 40' ' ' LEU . 85.6 Cg_exo -39.26 -20.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.597 2.198 . . . . 0.0 111.563 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.575 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -73.67 -53.89 9.37 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.676 -179.407 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.986 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.94 -25.6 62.81 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.569 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.751 HD22 ' HB2' ' A' ' 28' ' ' LEU . 9.6 mt -64.74 -54.68 27.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -57.81 -30.59 65.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.088 179.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.18 -44.35 95.63 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.025 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -65.82 -42.36 90.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.259 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.632 ' CD2' HD13 ' A' ' 28' ' ' LEU . 4.4 mm? -62.5 -31.97 72.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.146 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.31 -29.39 34.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.183 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.44 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -77.45 -42.48 35.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.393 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.633 ' OG ' ' HB2' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -72.41 14.13 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.653 0.263 . . . . 0.0 111.007 -179.39 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 46' ' ' ALA . 3.7 m-20 60.42 26.32 15.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.473 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.27 -23.38 34.54 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.48 127.52 31.9 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.595 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.4 OUTLIER -77.56 -57.63 5.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.125 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.595 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 14.4 m -47.84 -45.98 30.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.065 0.46 . . . . 0.0 110.506 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 41.8 mt-30 -61.71 -55.8 26.46 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.633 ' HB2' ' OG ' ' A' ' 47' ' ' SER . . . -41.47 -58.29 1.94 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.139 0.971 . . . . 0.0 108.511 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.881 ' O ' HG22 ' A' ' 59' ' ' THR . 18.1 t -43.56 -54.38 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.754 178.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.432 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 4.5 t -52.43 -44.95 65.74 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.612 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.664 ' O ' ' NE ' ' A' ' 62' ' ' ARG . 16.9 mt -57.45 -34.59 69.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.26 0.552 . . . . 0.0 110.888 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.025 HD21 ' HB2' ' A' ' 43' ' ' ALA . 13.8 mt -87.84 -26.89 22.57 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -177.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.881 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -105.96 3.79 28.77 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.094 -0.643 . . . . 0.0 111.26 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.479 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.4 OUTLIER -65.49 30.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.881 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.611 ' H ' ' C ' ' A' ' 59' ' ' THR . 3.1 tp10 75.58 66.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.559 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.664 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -133.64 -73.63 0.49 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.156 0.503 . . . . 0.0 111.751 -179.297 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.573 ' O ' ' O ' ' A' ' 64' ' ' LYS . 84.0 t -63.5 -92.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.558 -178.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.573 ' O ' ' O ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER 35.87 -163.55 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.29 -179.191 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -177.82 76.18 0.23 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.031 0.443 . . . . 0.0 110.806 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.572 ' O ' ' O ' ' A' ' 67' ' ' SER . 12.1 Cg_exo -66.98 -77.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.76 0 C-N-CA 122.85 2.367 . . . . 0.0 111.925 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 66' ' ' PRO . 5.4 p -26.68 150.04 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.922 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -76.05 135.81 39.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.5 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.69 -18.49 29.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.206 0.527 . . . . 0.0 110.613 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.567 ' OG1' ' N ' ' A' ' 71' ' ' VAL . 1.5 t -77.62 -119.98 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.479 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.666 HG23 ' N ' ' A' ' 72' ' ' ALA . 13.7 m -69.24 -138.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.369 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.666 ' N ' HG23 ' A' ' 71' ' ' VAL . . . -138.59 -37.99 0.53 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.489 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.586 ' C ' ' O ' ' A' ' 72' ' ' ALA . 21.6 m 11.08 -119.5 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.31 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.594 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.2 OUTLIER -45.11 144.06 2.21 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.476 -179.969 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.42 179.74 5.59 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 122.65 2.233 . . . . 0.0 112.187 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.62 -176.95 3.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.576 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -94.81 -102.56 0.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.097 0.475 . . . . 0.0 110.784 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.413 HG12 ' H ' ' A' ' 79' ' ' GLU . 1.6 t -148.94 -137.67 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.576 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.413 ' H ' HG12 ' A' ' 78' ' ' VAL . 11.3 mt-10 -132.25 -42.18 0.98 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -153.84 101.26 0.21 Allowed Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -175.55 1.68 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.822 0.344 . . . . 0.0 110.456 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -49.85 -76.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.571 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -176.94 -131.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.671 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -98.95 9.41 43.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.395 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 87' ' ' VAL . 37.2 tttp -94.44 -91.91 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 110.792 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.493 ' C ' HG23 ' A' ' 87' ' ' VAL . 4.9 pt-20 33.12 28.9 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.948 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 85' ' ' LYS . 88.2 t -158.32 142.47 6.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.817 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.531 ' N ' HD12 ' A' ' 88' ' ' LEU . 9.1 mp -89.89 -36.9 14.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.417 0.627 . . . . 0.0 109.972 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 57.51 75.68 0.36 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.268 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.42 ' O ' ' HB ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER 56.61 -143.42 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.108 179.086 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.722 ' O ' HG12 ' A' ' 91' ' ' VAL . 25.7 t 64.47 78.86 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.539 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.467 ' O ' ' O ' ' A' ' 91' ' ' VAL . 23.3 pt -42.38 168.76 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.472 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.461 ' O ' HD22 ' A' ' 94' ' ' LEU . 10.4 t0 175.26 94.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.395 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.461 HD22 ' O ' ' A' ' 93' ' ' ASP . 0.6 OUTLIER -123.99 -86.58 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.77 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.521 ' O ' ' OG1' ' A' ' 95' ' ' THR . 0.0 OUTLIER -111.56 53.24 0.72 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.629 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -143.45 -21.52 0.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.138 0.494 . . . . 0.0 110.398 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -144.61 66.74 1.26 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.578 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.4 ' OD1' ' C ' ' A' ' 98' ' ' ASN . 17.5 p30 -96.24 153.85 17.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.546 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.597 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -141.53 0.49 1.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.85 -179.755 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.54 ' O ' ' HB3' ' A' ' 104' ' ' ALA . 8.1 m-20 -44.56 -14.65 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.741 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.597 ' N ' ' O ' ' A' ' 99' ' ' LYS . 12.0 t70 -61.12 -60.92 3.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.311 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.108 HD23 ' N ' ' A' ' 103' ' ' GLN . 0.4 OUTLIER -83.42 -29.04 28.43 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 120.244 -0.582 . . . . 0.0 110.705 179.786 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 1.108 ' N ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -64.4 -40.72 96.34 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.529 -0.869 . . . . 0.0 109.341 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 100' ' ' ASP . . . -79.74 -55.59 4.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.919 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.88 -46.61 71.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.159 0.504 . . . . 0.0 109.669 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.686 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.3 mm -62.58 -47.93 90.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.996 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.29 98.58 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.223 -178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -41.02 98.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -18.37 36.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.091 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.994 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.2 tm? -93.73 -12.05 30.08 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.528 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.72 -29.1 25.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.592 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.5 ' O ' ' CB ' ' A' ' 113' ' ' SER . 54.1 mm-40 -90.91 -94.12 0.13 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.552 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 112' ' ' GLU . 1.9 t 81.37 115.39 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.706 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -76.28 -176.16 2.93 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.231 1.954 . . . . 0.0 112.068 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -123.98 151.62 43.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.627 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -91.2 -169.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.358 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -118.0 39.59 3.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.691 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.39 -111.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.392 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.557 ' CG ' ' N ' ' A' ' 120' ' ' GLY . 7.9 t70 -154.15 -104.41 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.587 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.557 ' N ' ' CG ' ' A' ' 119' ' ' ASP . . . . . . . . 0 C--O 1.22 -0.741 0 CA-C-O 118.0 -1.445 . . . . 0.0 110.821 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.462 ' HB ' HD23 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -88.78 -166.33 1.57 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.822 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.8 -36.58 3.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.186 0.517 . . . . 0.0 110.527 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -84.84 -116.33 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.611 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.82 ' N ' HD22 ' A' ' 5' ' ' LEU . 2.9 mm? 51.87 178.99 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.371 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -158.7 53.46 0.42 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.569 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -76.0 3.65 9.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.506 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.433 ' O ' ' C ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -95.17 -18.6 20.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.544 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.675 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 1.8 p-10 -35.66 -61.54 0.46 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.963 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.675 ' N ' ' CG ' ' A' ' 9' ' ' ASP . . . 32.89 99.08 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.252 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -113.79 120.36 40.52 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.903 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -99.88 128.79 9.69 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ASP . . . -104.02 -165.78 1.19 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.816 0.341 . . . . 0.0 110.43 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.548 ' O ' ' C ' ' A' ' 15' ' ' ASP . . . -67.43 72.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.301 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.548 ' C ' ' O ' ' A' ' 14' ' ' ALA . 2.2 m-20 -25.53 -75.61 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.759 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 140.38 -9.06 2.93 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -79.9 150.86 30.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.788 0.328 . . . . 0.0 110.41 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.06 121.92 2.02 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.6 t -87.62 176.83 7.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.733 0.301 . . . . 0.0 110.537 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 t -150.15 113.01 4.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.464 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.506 ' C ' ' H ' ' A' ' 23' ' ' MET . 0.1 OUTLIER -128.07 145.61 50.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.956 0.408 . . . . 0.0 110.825 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -47.2 -12.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.644 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.744 ' N ' ' SD ' ' A' ' 23' ' ' MET . 0.0 OUTLIER -65.68 -47.86 74.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.147 0.499 . . . . 0.0 110.907 -179.631 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.476 ' H ' HD12 ' A' ' 24' ' ' LEU . 3.6 mp -61.98 -48.59 79.67 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.071 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.941 HD22 ' H ' ' A' ' 25' ' ' LEU . 1.9 mm? -62.53 -52.96 61.4 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.158 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -53.4 -45.97 69.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.379 0.609 . . . . 0.0 110.118 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' N ' ' A' ' 30' ' ' GLU . 2.6 mm-40 -57.32 -58.77 6.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.835 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.962 HD22 ' CD2' ' A' ' 44' ' ' LEU . 12.4 tp -44.68 -54.27 6.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.97 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -63.03 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.374 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 27' ' ' GLN . 29.6 tt0 -79.29 -21.21 46.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.998 0.428 . . . . 0.0 110.398 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.448 HG21 HG11 ' A' ' 55' ' ' VAL . 59.4 mt -93.96 -44.29 13.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.383 0.611 . . . . 0.0 111.215 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.533 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.1 p -91.44 -37.45 13.18 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.312 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.444 ' O ' ' OE1' ' A' ' 79' ' ' GLU . . . 86.99 34.77 10.48 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.64 HG21 ' CD1' ' A' ' 39' ' ' PHE . 1.1 mm -100.09 142.27 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.773 0.321 . . . . 0.0 110.39 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.506 ' NE2' ' H ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -113.85 23.29 13.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.792 -179.664 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.635 ' O ' ' N ' ' A' ' 38' ' ' SER . 36.4 t0 -112.52 72.51 1.31 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -34.96 -22.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.691 0 C-N-CA 122.877 2.385 . . . . 0.0 112.336 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.635 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.8 OUTLIER -73.68 -52.66 12.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.938 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 1.075 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -72.26 -26.01 61.83 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.943 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.643 HD23 HD23 ' A' ' 28' ' ' LEU . 1.2 mp -71.91 -53.17 13.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -60.72 -24.92 66.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.128 178.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -65.79 -46.11 79.93 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.922 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -61.53 -51.52 68.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.071 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.962 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.3 mm? -55.04 -36.27 65.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.207 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 4.4 tmtt? -76.54 -28.74 56.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.446 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.469 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.32 -20.88 33.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.914 0.388 . . . . 0.0 110.735 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.42 ' OG ' ' HB2' ' A' ' 53' ' ' GLN . 42.2 t -93.02 -6.83 47.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.381 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.521 ' N ' ' OD1' ' A' ' 48' ' ' ASN . 0.6 OUTLIER 74.75 26.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.055 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.12 -21.59 41.07 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.35 123.64 20.93 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.73 ' O ' HG23 ' A' ' 55' ' ' VAL . 2.2 tt -75.56 -56.03 9.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.036 -179.15 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.639 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.2 m -46.09 -52.34 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.809 0.337 . . . . 0.0 110.662 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.615 ' O ' HD12 ' A' ' 57' ' ' LEU . 28.1 mt-30 -59.64 -53.68 55.23 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.37 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.0 -53.52 2.95 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.855 ' O ' HG22 ' A' ' 59' ' ' THR . 39.5 t -47.73 -58.73 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.949 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.2 t -46.02 -48.53 16.74 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.249 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.665 ' O ' ' NE ' ' A' ' 62' ' ' ARG . 6.6 mp -62.53 -27.64 69.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.199 0.523 . . . . 0.0 111.02 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.075 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 52.6 mt -90.31 -14.02 34.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.853 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.855 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -118.2 -0.22 11.6 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.329 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.531 ' H ' ' HD3' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -64.63 27.14 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.771 0.32 . . . . 0.0 110.598 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.656 ' H ' ' C ' ' A' ' 59' ' ' THR . 1.0 OUTLIER 79.52 36.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.362 179.448 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.665 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -91.64 -52.21 4.87 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 121.329 0.585 . . . . 0.0 110.379 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.534 HG12 ' N ' ' A' ' 64' ' ' LYS . 48.6 t -95.01 -107.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.589 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.534 ' N ' HG12 ' A' ' 63' ' ' VAL . 0.0 OUTLIER 173.72 -105.04 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.517 179.046 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.883 ' H ' ' CD ' ' A' ' 66' ' ' PRO . 0.0 OUTLIER 177.23 -18.43 0.0 OUTLIER Pre-proline 0 CA--C 1.546 0.81 0 N-CA-C 114.22 1.193 . . . . 0.0 114.22 -179.302 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.883 ' CD ' ' H ' ' A' ' 65' ' ' GLU . 51.3 Cg_exo -55.2 -151.8 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.221 0 C-N-CA 121.953 1.769 . . . . 0.0 112.893 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.654 ' OG ' ' N ' ' A' ' 68' ' ' GLN . 5.1 t 169.01 -166.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.587 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.654 ' N ' ' OG ' ' A' ' 67' ' ' SER . 9.7 mt-30 -127.75 171.56 11.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.906 0.384 . . . . 0.0 110.7 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -68.38 -18.54 64.49 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.238 0.542 . . . . 0.0 110.501 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.1 p -107.54 -170.31 1.68 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.572 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.906 HG22 ' H ' ' A' ' 72' ' ' ALA . 3.0 p -81.76 -150.8 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.739 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.906 ' H ' HG22 ' A' ' 71' ' ' VAL . . . -122.65 -64.73 1.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.215 0.531 . . . . 0.0 110.988 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.404 ' CB ' ' O ' ' A' ' 72' ' ' ALA . 0.2 OUTLIER 75.99 -70.32 0.14 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.466 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.525 ' H ' ' HD2' ' A' ' 75' ' ' PRO . 6.2 mt-10 -153.75 -63.32 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.504 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.525 ' HD2' ' H ' ' A' ' 74' ' ' GLU . 17.8 Cg_endo -59.41 -95.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 122.743 2.295 . . . . 0.0 111.991 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 6.9 t 61.02 -179.86 0.11 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.637 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.567 ' N ' ' OE1' ' A' ' 68' ' ' GLN . 29.5 mm-40 -106.07 -37.88 6.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.464 0.649 . . . . 0.0 110.31 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 1.005 HG22 ' H ' ' A' ' 79' ' ' GLU . 8.9 p -152.63 -131.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.74 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 1.005 ' H ' HG22 ' A' ' 78' ' ' VAL . 7.3 mt-10 -60.9 -128.59 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.941 -0.303 . . . . 0.0 110.479 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -174.41 10.12 0.03 OUTLIER Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.83 -0.908 . . . . 0.0 110.83 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 90.5 p -76.05 -172.56 2.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.919 0.39 . . . . 0.0 110.641 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.4 137.61 58.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.74 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -105.68 167.13 9.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.183 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.571 ' O ' ' O ' ' A' ' 85' ' ' LYS . 1.5 m-20 -110.67 35.7 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.783 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.571 ' O ' ' O ' ' A' ' 84' ' ' ASN . 2.1 ttmm -52.74 -120.26 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.924 0.392 . . . . 0.0 110.725 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.486 ' H ' ' HG2' ' A' ' 85' ' ' LYS . 14.5 tt0 -64.98 -83.63 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.584 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.43 157.98 34.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.635 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.486 HD23 ' O ' ' A' ' 89' ' ' ALA . 7.1 tt -70.22 -27.72 64.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.603 0.716 . . . . 0.0 109.509 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.486 ' O ' HD23 ' A' ' 88' ' ' LEU . . . 61.02 174.46 0.11 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.324 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.417 ' HG3' ' H ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -127.25 -177.97 4.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.647 -179.775 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 91' ' ' VAL . 75.2 t -140.77 69.98 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.403 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.3 pt -81.47 135.26 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.361 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.5 t70 179.63 105.49 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.164 0.506 . . . . 0.0 110.377 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 28.3 mt -142.63 -89.17 0.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.111 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.523 HG23 ' O ' ' A' ' 95' ' ' THR . 2.4 t -121.75 90.09 3.24 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.325 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -86.64 -28.45 23.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.024 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.401 ' O ' ' C ' ' A' ' 98' ' ' ASN . 12.3 t70 -94.2 61.28 2.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.528 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 97' ' ' ASP . 0.2 OUTLIER -38.89 136.89 0.72 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.562 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 103' ' ' GLN . 2.0 pttt -140.18 -86.99 0.2 Allowed 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.469 0.652 . . . . 0.0 110.976 -179.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.485 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 2.3 m-20 -67.92 -25.18 65.35 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.329 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.37 -60.72 3.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.312 -179.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.906 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -81.39 -22.52 38.24 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.73 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.889 ' N ' HD22 ' A' ' 102' ' ' LEU . 23.1 mt-30 -66.71 -40.84 88.61 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.677 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.95 -53.22 9.37 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.362 -1.29 . . . . 0.0 111.026 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.68 -51.52 68.43 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.663 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -55.38 -45.01 77.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.938 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.45 ' O ' ' CB ' ' A' ' 111' ' ' LEU . . . -68.89 -31.04 69.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.136 -179.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -28.0 63.27 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.013 0.435 . . . . 0.0 109.854 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.7 -18.66 16.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 106' ' ' ILE . 4.7 tt -97.92 -16.77 19.58 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.571 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.45 ' CB ' ' O ' ' A' ' 107' ' ' ALA . 2.9 tt -101.22 -23.65 14.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.753 -179.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.549 ' O ' ' C ' ' A' ' 113' ' ' SER . 0.3 OUTLIER -121.11 -20.29 6.84 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.764 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.549 ' C ' ' O ' ' A' ' 112' ' ' GLU . 0.9 OUTLIER 22.12 78.74 0.2 Allowed Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.148 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.98 -157.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.774 2.316 . . . . 0.0 112.013 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 6.6 mptt -87.11 -117.43 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.286 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 116' ' ' ILE . 1.3 mt -142.77 160.1 18.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.388 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.424 ' O ' ' O ' ' A' ' 118' ' ' ALA . 70.2 mt-30 -104.12 42.06 1.23 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.519 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.448 ' O ' ' OD1' ' A' ' 119' ' ' ASP . . . 40.79 -162.52 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.476 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 118' ' ' ALA . 1.0 OUTLIER -162.93 -91.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.59 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.691 0 CA-C-O 117.999 -1.445 . . . . 0.0 111.038 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptt? . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.448 HG23 ' N ' ' A' ' 3' ' ' ALA . 2.8 t -158.96 -171.21 3.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.439 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.448 ' N ' HG23 ' A' ' 2' ' ' THR . . . -78.17 -149.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.693 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -61.31 -178.2 0.11 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.813 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.827 ' H ' HD22 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -90.69 178.56 6.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.434 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.554 ' C ' ' O ' ' A' ' 5' ' ' LEU . 3.5 mt-30 26.83 94.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.574 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -63.26 -120.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.042 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -44.71 -26.54 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.036 0.446 . . . . 0.0 111.151 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.55 -20.77 58.02 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.709 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.83 -121.12 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.771 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.45 89.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.439 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.43 120.53 0.61 Allowed Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.73 158.4 15.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.333 . . . . 0.0 110.507 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . -77.77 -145.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.521 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.48 ' C ' ' O ' ' A' ' 14' ' ' ALA . 89.0 m-20 -32.1 -36.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.526 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . 130.66 -4.21 5.79 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.821 -0.912 . . . . 0.0 110.821 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -107.74 143.39 36.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.801 0.334 . . . . 0.0 110.628 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 159.53 143.3 3.62 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.961 -0.855 . . . . 0.0 110.961 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.9 m -110.95 -59.58 1.95 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.813 0.339 . . . . 0.0 110.613 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -46.37 147.07 1.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.611 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.8 t -118.6 145.49 45.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.64 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.532 ' N ' ' OE1' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -48.01 -22.57 0.62 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.759 -179.857 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 14.7 mtt -69.73 -22.86 63.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.974 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 mp -70.61 -62.88 1.22 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.329 0.585 . . . . 0.0 110.517 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.849 HD23 ' H ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -62.84 -35.89 81.43 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.241 179.711 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -62.2 -55.83 24.64 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.215 0.531 . . . . 0.0 110.139 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER -52.56 -60.55 3.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.649 179.263 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.88 HD23 HD23 ' A' ' 40' ' ' LEU . 11.1 tp -46.45 -51.86 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.554 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -60.91 -21.29 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.437 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.467 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.3 tt0 -86.43 -24.25 25.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.48 HD12 ' HA ' ' A' ' 28' ' ' LEU . 31.3 mt -87.26 -53.35 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 CA-C-O 121.889 0.852 . . . . 0.0 110.537 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.496 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.7 p -82.63 -37.29 25.16 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.048 -1.433 . . . . 0.0 111.675 -178.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.28 35.34 17.96 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.694 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -99.41 142.42 15.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.893 0.378 . . . . 0.0 110.827 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -112.96 23.35 13.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.46 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.694 ' H ' HG22 ' A' ' 34' ' ' ILE . 15.2 m-20 -112.39 73.94 1.46 Allowed Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.441 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -35.36 -24.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.605 2.203 . . . . 0.0 112.021 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.611 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -71.88 -52.98 14.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.258 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 1.032 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.99 -25.21 62.6 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.766 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.88 HD23 HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -71.84 -47.84 50.27 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.771 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -65.26 -26.96 68.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.123 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.51 -53.77 42.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.903 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -59.69 -38.37 81.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.261 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.75 ' CD2' HD22 ' A' ' 28' ' ' LEU . 3.3 mm? -67.36 -30.12 69.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.934 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -77.26 -33.94 55.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.11 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.489 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -81.86 -37.9 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.749 -179.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 48' ' ' ASN . 32.0 p -67.53 -12.75 61.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.757 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.411 ' CB ' ' O ' ' A' ' 47' ' ' SER . 8.4 t-20 74.03 37.79 0.61 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.83 -23.58 30.25 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -67.71 125.61 26.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.833 0.349 . . . . 0.0 110.281 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.633 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.6 OUTLIER -78.02 -57.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -179.636 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.633 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 18.5 m -45.39 -53.04 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.937 0.399 . . . . 0.0 110.568 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.68 ' O ' HD12 ' A' ' 57' ' ' LEU . 44.9 mt-30 -55.69 -55.33 33.47 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.283 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.412 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.33 -54.04 3.12 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.586 0.708 . . . . 0.0 109.149 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.635 ' O ' HG22 ' A' ' 59' ' ' THR . 61.6 t -47.57 -56.96 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.635 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -51.28 -46.67 62.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.306 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.68 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.1 mp -60.2 -34.54 73.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 0.0 111.327 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.032 HD22 ' CE2' ' A' ' 39' ' ' PHE . 18.8 mt -81.44 -58.18 3.14 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.428 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.693 ' O ' ' N ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -82.21 5.52 19.59 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.672 -178.797 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.576 ' C ' ' O ' ' A' ' 59' ' ' THR . 0.5 OUTLIER -28.12 -35.51 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.568 0.699 . . . . 0.0 109.54 179.808 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.693 ' N ' ' O ' ' A' ' 59' ' ' THR . 2.5 pm0 -132.76 -39.23 0.98 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.19 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.659 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 1.4 tpt180 174.19 -67.8 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.757 179.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.658 ' N ' ' OE2' ' A' ' 61' ' ' GLU . 0.9 OUTLIER 175.51 -23.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.789 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.471 ' N ' ' CD ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -134.06 -157.02 0.78 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.933 0.397 . . . . 0.0 111.086 -179.84 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.441 ' N ' ' HG2' ' A' ' 64' ' ' LYS . 80.0 mt-10 -105.4 77.24 0.36 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.381 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -64.84 -47.51 4.99 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.139 1.893 . . . . 0.0 112.216 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 m -78.95 108.35 12.36 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.38 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -127.81 144.71 51.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.769 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -90.84 -19.42 23.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.281 0.562 . . . . 0.0 110.518 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.7 p -110.7 132.84 53.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.539 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.642 ' CG2' ' N ' ' A' ' 72' ' ' ALA . 1.5 p -161.64 171.5 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.407 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.642 ' N ' ' CG2' ' A' ' 71' ' ' VAL . . . -77.95 -45.51 23.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.054 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.659 ' OG1' ' N ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -110.5 -159.5 0.68 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.422 -179.494 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.659 ' N ' ' OG1' ' A' ' 73' ' ' THR . 5.7 mm-40 -31.77 130.66 0.29 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.975 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.608 ' O ' ' O ' ' A' ' 74' ' ' GLU . 52.8 Cg_exo -48.27 -151.87 0.0 OUTLIER 'Trans proline' 0 N--CA 1.493 1.488 0 C-N-CA 122.483 2.122 . . . . 0.0 112.348 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.512 ' O ' ' O ' ' A' ' 75' ' ' PRO . 8.5 t -45.62 179.78 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.665 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.427 ' C ' HG23 ' A' ' 78' ' ' VAL . 2.9 mp0 -68.07 -7.29 28.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.737 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.733 HG12 ' H ' ' A' ' 79' ' ' GLU . 19.5 t -153.12 174.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.568 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.733 ' H ' HG12 ' A' ' 78' ' ' VAL . 4.7 mm-40 -82.1 -158.11 0.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.622 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -62.86 120.2 20.45 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.21 169.41 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.859 0.361 . . . . 0.0 110.525 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -46.42 134.35 9.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.693 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.25 158.7 44.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.584 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.492 ' O ' ' O ' ' A' ' 85' ' ' LYS . 2.6 m120 -139.87 19.83 2.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.743 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.504 ' C ' ' H ' ' A' ' 87' ' ' VAL . 13.9 tttm -45.81 177.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.31 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.535 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 13.1 tt0 -61.64 2.45 0.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.647 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.541 HG12 ' H ' ' A' ' 89' ' ' ALA . 2.8 t -124.58 150.4 29.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.171 0.51 . . . . 0.0 110.734 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.57 ' H ' HD12 ' A' ' 88' ' ' LEU . 5.3 mp -81.51 -23.74 37.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.241 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.541 ' H ' HG12 ' A' ' 87' ' ' VAL . . . 56.69 22.65 7.03 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.462 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.854 ' O ' HG13 ' A' ' 91' ' ' VAL . 0.0 OUTLIER -147.25 147.27 30.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.146 -179.772 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.854 HG13 ' O ' ' A' ' 90' ' ' LYS . 3.2 m -167.95 77.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.279 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.525 ' C ' ' O ' ' A' ' 91' ' ' VAL . 1.2 pt -29.94 129.29 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.597 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.627 ' C ' ' H ' ' A' ' 95' ' ' THR . 18.6 t0 178.03 41.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.146 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.451 ' C ' ' CG2' ' A' ' 95' ' ' THR . 0.2 OUTLIER 70.51 -17.97 0.26 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.577 0.703 . . . . 0.0 109.936 -179.797 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.627 ' H ' ' C ' ' A' ' 93' ' ' ASP . 0.1 OUTLIER 35.89 92.2 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.004 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.46 ' CG ' ' H ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -68.33 -115.43 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.335 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.46 ' H ' ' CG ' ' A' ' 96' ' ' HIS . 0.2 OUTLIER -94.21 150.23 20.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.466 179.688 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.422 ' N ' ' OD1' ' A' ' 98' ' ' ASN . 1.6 m120 -135.09 144.61 47.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.617 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -157.76 -12.68 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.498 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.495 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 3.8 p30 -45.1 -17.02 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.843 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 99' ' ' LYS . 2.0 t70 -63.51 -59.3 4.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.963 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.961 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.5 pp -76.25 -32.03 58.66 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.364 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.961 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.9 OUTLIER -63.41 -38.49 91.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.724 0.774 . . . . 0.0 109.508 -179.028 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.51 -56.41 4.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.595 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.64 -55.02 29.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.667 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.6 mm -51.89 -52.96 19.72 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.754 179.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.86 73.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.057 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.774 HD23 ' O ' ' A' ' 108' ' ' LEU . 8.6 tt -58.18 -32.52 68.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.884 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.06 -18.14 22.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.984 0.421 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.981 ' O ' HD12 ' A' ' 110' ' ' LEU . 1.1 tp -88.53 -17.83 29.43 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.71 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.7 tp -82.41 -24.57 34.3 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.138 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.588 ' O ' ' C ' ' A' ' 113' ' ' SER . 1.9 mt-10 -138.54 -96.82 0.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.524 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.588 ' C ' ' O ' ' A' ' 112' ' ' GLU . 1.6 m -13.37 100.02 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.438 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -79.84 -94.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.737 2.292 . . . . 0.0 112.469 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.5 ptpp? -100.82 -170.5 1.86 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.124 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.406 HG21 HD13 ' A' ' 116' ' ' ILE . 0.9 OUTLIER -114.89 169.51 5.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.763 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.406 ' H ' HG22 ' A' ' 116' ' ' ILE . 0.3 OUTLIER -78.75 24.58 0.29 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.744 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.4 ' H ' ' C ' ' A' ' 116' ' ' ILE . . . -117.84 -179.6 3.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.529 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -149.37 -57.9 0.2 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.754 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.784 0 CA-C-O 118.011 -1.438 . . . . 0.0 110.911 179.946 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mtt . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.7 t -115.24 -163.98 0.92 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.751 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -153.25 -140.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.497 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.537 ' C ' HD13 ' A' ' 5' ' ' LEU . 15.2 mt-10 -64.11 158.96 21.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.44 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.976 ' N ' HD22 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -106.13 -153.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.927 0.394 . . . . 0.0 110.783 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -139.47 -168.69 2.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.273 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.43 ' HG2' ' N ' ' A' ' 8' ' ' ASP . 38.2 tt0 -130.7 -118.8 0.22 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.463 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.43 ' N ' ' HG2' ' A' ' 7' ' ' GLN . 0.2 OUTLIER -62.88 -18.57 63.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.993 0.425 . . . . 0.0 110.438 179.85 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.454 ' O ' ' C ' ' A' ' 10' ' ' ALA . 49.5 t0 -44.78 -47.48 10.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.716 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.571 ' O ' ' O ' ' A' ' 11' ' ' ALA . . . 33.0 -130.13 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.905 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.571 ' O ' ' O ' ' A' ' 10' ' ' ALA . . . -35.03 163.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.86 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -162.14 153.77 24.54 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -145.87 -127.76 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.816 0.341 . . . . 0.0 110.498 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.547 ' O ' ' O ' ' A' ' 15' ' ' ASP . . . -139.39 128.69 24.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.51 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.547 ' O ' ' O ' ' A' ' 14' ' ' ALA . 8.1 m-20 -36.05 161.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.222 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -109.85 41.46 2.23 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -149.68 24.53 0.87 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.817 0.342 . . . . 0.0 110.473 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -93.69 54.71 2.32 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.453 ' OG ' ' N ' ' A' ' 20' ' ' SER . 4.1 t -104.74 -99.02 0.32 Allowed 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.939 -0.305 . . . . 0.0 110.515 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.453 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.4 OUTLIER 68.11 176.65 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.616 179.875 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.685 ' O ' HD21 ' A' ' 24' ' ' LEU . 0.8 OUTLIER -127.59 167.6 16.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.817 -179.719 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.418 ' HB3' HD11 ' A' ' 25' ' ' LEU . 36.1 mm-40 -81.76 -13.43 57.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.02 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 28.7 mtt -54.17 -32.07 54.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.846 0.355 . . . . 0.0 111.484 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.685 HD21 ' O ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -68.7 -60.93 2.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.685 -179.115 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.819 HD12 ' N ' ' A' ' 26' ' ' ASN . 1.8 pp -62.76 -38.93 92.52 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.948 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.819 ' N ' HD12 ' A' ' 25' ' ' LEU . 8.3 t-20 -63.81 -58.32 7.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.236 0.541 . . . . 0.0 110.757 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -53.49 -59.02 5.13 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.948 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.756 HD13 HD21 ' A' ' 44' ' ' LEU . 6.6 tp -52.88 -57.93 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.908 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -59.4 -21.52 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.29 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.2 -35.01 25.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.826 0.346 . . . . 0.0 110.769 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.612 HG21 HG11 ' A' ' 55' ' ' VAL . 38.6 mt -73.0 -52.41 22.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-O 121.659 0.743 . . . . 0.0 110.684 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.477 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.0 p -79.74 -35.32 39.02 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.609 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 67.28 36.15 89.11 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.812 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -89.32 155.71 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.256 -0.472 . . . . 0.0 111.705 -178.2 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -122.26 23.35 9.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.608 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.812 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -119.77 70.09 13.41 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -34.83 -20.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.962 2.441 . . . . 0.0 112.221 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.669 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -73.73 -52.43 13.23 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.632 179.66 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.953 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.33 -25.38 64.18 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.514 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mt -69.61 -59.79 2.74 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.723 ' HD1' ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -57.51 -27.57 62.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.447 179.136 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.723 ' N ' ' HD1' ' A' ' 41' ' ' HIS . 62.9 tt0 -61.3 -56.77 16.74 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.67 179.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.935 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -58.56 -38.7 78.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.756 HD21 HD13 ' A' ' 28' ' ' LEU . 2.0 mm? -67.59 -24.9 65.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.96 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.449 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.43 -30.59 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.179 179.237 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.449 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -82.07 -36.95 27.12 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.813 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.584 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 41.4 t -72.58 -16.24 61.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 73.6 36.38 0.78 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.956 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.66 -23.69 35.13 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.584 ' O ' ' OG ' ' A' ' 47' ' ' SER . 0.4 OUTLIER -66.97 116.08 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.943 ' O ' HG23 ' A' ' 55' ' ' VAL . 1.7 tt -70.15 -50.88 43.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.408 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.638 ' N ' HG23 ' A' ' 51' ' ' ILE . 54.4 m -50.87 -61.44 2.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.289 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.721 ' O ' HD12 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -49.85 -56.24 11.19 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.887 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.05 -55.18 2.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.943 HG23 ' O ' ' A' ' 51' ' ' ILE . 21.4 t -47.24 -58.57 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.746 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.6 t -48.47 -50.08 32.97 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.721 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.0 mp -55.4 -36.78 66.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.196 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.953 HD22 ' CE2' ' A' ' 39' ' ' PHE . 25.5 mt -80.5 -62.21 1.74 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.941 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.647 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -71.77 -2.14 16.51 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.542 -178.33 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.55 ' C ' ' O ' ' A' ' 59' ' ' THR . 19.2 t0 -26.39 -50.78 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.913 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 179.91 49.14 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.114 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.666 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -132.29 -101.89 0.27 Allowed 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.133 0.492 . . . . 0.0 110.467 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.958 HG23 ' H ' ' A' ' 64' ' ' LYS . 12.9 m -61.83 -66.14 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.406 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.958 ' H ' HG23 ' A' ' 63' ' ' VAL . 2.1 pttp 31.73 -158.89 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.874 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.491 ' N ' ' HD3' ' A' ' 66' ' ' PRO . 0.8 OUTLIER 168.65 59.42 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.786 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.491 ' HD3' ' N ' ' A' ' 65' ' ' GLU . 94.3 Cg_endo -85.21 -155.46 0.06 OUTLIER 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.983 2.455 . . . . 0.0 112.466 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 m -121.69 99.76 6.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.207 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -122.96 -22.81 5.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.115 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.587 ' O ' ' O ' ' A' ' 70' ' ' THR . 3.4 t0 -79.45 -23.21 43.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.047 0.451 . . . . 0.0 110.985 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.587 ' O ' ' O ' ' A' ' 69' ' ' ASP . 7.8 p 52.2 130.89 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.768 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.643 ' CG2' ' N ' ' A' ' 72' ' ' ALA . 0.3 OUTLIER -161.2 164.95 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.348 0.594 . . . . 0.0 110.985 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.643 ' N ' ' CG2' ' A' ' 71' ' ' VAL . . . -55.82 -99.55 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.134 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.775 HG22 ' H ' ' A' ' 74' ' ' GLU . 3.7 m -52.22 178.6 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.453 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.775 ' H ' HG22 ' A' ' 73' ' ' THR . 21.0 tp10 63.23 80.27 0.25 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.319 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -45.66 160.75 0.15 Allowed 'Trans proline' 0 C--N 1.305 -1.75 0 C-N-CA 122.787 2.324 . . . . 0.0 111.864 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.44 155.68 39.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.5 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -68.64 -6.29 25.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.558 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 1.016 HG12 ' H ' ' A' ' 79' ' ' GLU . 3.9 t -134.1 -147.73 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.82 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 1.016 ' H ' HG12 ' A' ' 78' ' ' VAL . 1.5 pt-20 -126.37 -154.51 0.63 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.617 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.06 61.65 1.56 Allowed Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.581 ' O ' ' O ' ' A' ' 82' ' ' ALA . 97.9 p -119.89 -170.19 1.91 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.787 0.327 . . . . 0.0 110.642 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.581 ' O ' ' O ' ' A' ' 81' ' ' SER . . . -48.97 -167.62 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.53 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -138.54 -166.03 1.92 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.56 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.404 ' H ' ' H ' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -152.28 -6.06 0.22 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.244 179.917 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.404 ' H ' ' H ' ' A' ' 84' ' ' ASN . 4.1 mtpp -42.92 164.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.444 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -179.53 79.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.459 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -146.49 131.7 12.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.768 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.93 -27.9 67.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.302 0.573 . . . . 0.0 110.207 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 60.83 -87.52 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.353 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.03 -169.12 0.08 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.646 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 1.017 HG13 ' H ' ' A' ' 92' ' ' ILE . 4.2 p -95.69 -99.06 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.675 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 1.017 ' H ' HG13 ' A' ' 91' ' ' VAL . 1.9 pt -142.33 179.6 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.421 ' CB ' ' O ' ' A' ' 92' ' ' ILE . 16.7 t0 75.53 90.87 0.08 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.028 0.442 . . . . 0.0 110.393 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.038 HD23 ' H ' ' A' ' 95' ' ' THR . 0.4 OUTLIER -109.99 -49.24 3.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.559 0.695 . . . . 0.0 110.357 -179.657 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . 1.038 ' H ' HD23 ' A' ' 94' ' ' LEU . 30.9 m -162.62 65.22 0.21 Allowed 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.643 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.412 ' CG ' ' O ' ' A' ' 95' ' ' THR . 14.2 m-70 -166.84 159.01 13.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.734 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 176.21 81.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.365 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.691 ' O ' ' N ' ' A' ' 101' ' ' ASP . 8.5 m-20 -128.96 -25.97 2.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.159 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.791 ' O ' HD23 ' A' ' 102' ' ' LEU . 3.3 ptpp? 19.06 -95.28 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.004 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -40.34 63.58 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.335 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.691 ' N ' ' O ' ' A' ' 98' ' ' ASN . 0.3 OUTLIER -52.87 -59.42 4.53 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.843 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.008 HD23 ' H ' ' A' ' 103' ' ' GLN . 0.9 OUTLIER -77.18 -34.76 56.25 Favored 'General case' 0 C--O 1.21 -0.976 0 C-N-CA 120.304 -0.559 . . . . 0.0 112.425 -178.441 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 1.008 ' H ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -63.22 -35.66 81.08 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.806 0.812 . . . . 0.0 109.561 -178.766 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.68 -56.57 4.2 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.442 -1.253 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.62 -47.7 73.12 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.518 0.675 . . . . 0.0 109.289 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.675 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.8 mm -61.08 -46.72 96.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.612 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.771 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 103' ' ' GLN . . . -60.39 -45.7 92.62 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.85 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.3 tp -59.62 -43.33 93.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.647 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.0 -19.17 34.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.245 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.963 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? -87.55 -15.87 36.21 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.77 -28.3 68.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.519 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.483 ' O ' ' O ' ' A' ' 113' ' ' SER . 4.0 mm-40 -115.35 -102.11 0.42 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.156 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.483 ' O ' ' O ' ' A' ' 112' ' ' GLU . 0.0 OUTLIER -39.65 165.22 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.502 179.854 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -75.18 -168.68 0.54 Allowed 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.863 2.376 . . . . 0.0 112.372 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.23 -149.98 0.46 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.395 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 1.1 mt -102.03 170.01 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.391 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -106.0 70.37 0.85 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.678 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -77.12 -139.99 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.516 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.45 -105.96 0.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.57 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.777 0 CA-C-O 117.994 -1.448 . . . . 0.0 110.849 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttm . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.63 102.76 14.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.648 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -115.36 -174.43 2.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.286 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.735 ' HB3' HD13 ' A' ' 5' ' ' LEU . 1.1 tp10 69.61 -83.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.502 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.03 ' H ' HD13 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -80.06 -174.34 4.42 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.515 179.576 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.9 OUTLIER -138.48 175.96 9.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.908 0.385 . . . . 0.0 110.663 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.556 ' O ' ' N ' ' A' ' 10' ' ' ALA . 3.1 mp0 -100.26 -88.39 0.35 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.439 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -43.53 -21.56 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.778 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.44 ' N ' ' C ' ' A' ' 7' ' ' GLN . 0.7 OUTLIER -90.71 -28.91 18.01 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.698 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.645 ' HB3' ' O ' ' A' ' 6' ' ' GLN . . . -111.17 130.41 55.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.38 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.77 177.77 4.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.651 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 47.09 -113.62 1.3 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -130.83 171.63 12.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.765 0.317 . . . . 0.0 110.433 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.49 159.99 22.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.541 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -167.25 1.46 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.342 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -106.95 99.53 1.45 Allowed Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.684 ' ND1' ' N ' ' A' ' 18' ' ' GLY . 4.9 p80 -47.53 -33.0 5.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.729 0.3 . . . . 0.0 110.651 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.684 ' N ' ' ND1' ' A' ' 17' ' ' HIS . . . 179.01 -164.09 32.14 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' A' ' 20' ' ' SER . 4.9 p -118.2 -139.24 0.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.788 0.328 . . . . 0.0 110.499 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.597 ' N ' ' OG ' ' A' ' 19' ' ' SER . 10.8 t -156.65 137.93 13.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.701 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.5 167.88 9.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.47 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.624 ' O ' ' CD1' ' A' ' 25' ' ' LEU . 9.1 mt-30 -80.0 -18.44 50.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.372 0.606 . . . . 0.0 110.245 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.602 ' N ' ' SD ' ' A' ' 23' ' ' MET . 0.1 OUTLIER -70.96 -19.19 62.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.572 -179.868 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.684 ' O ' ' CD2' ' A' ' 28' ' ' LEU . 10.0 mp -68.54 -65.84 0.65 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.469 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.037 HD13 ' H ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -65.64 -33.92 77.01 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.587 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 1.037 ' H ' HD13 ' A' ' 25' ' ' LEU . 62.1 t30 -64.57 -40.95 96.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.173 0.511 . . . . 0.0 109.986 178.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 23' ' ' MET . 10.3 mm100 -65.59 -63.66 1.04 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.6 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.816 HD22 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -51.33 -48.72 62.33 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 119.807 -0.757 . . . . 0.0 110.479 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.75 -22.35 65.23 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.141 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.609 ' CG ' ' O ' ' A' ' 26' ' ' ASN . 15.2 mm-40 -85.86 -20.86 28.48 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.981 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 94.1 mt -94.49 -38.8 9.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-O 121.6 0.714 . . . . 0.0 110.927 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 28' ' ' LEU . 11.4 p -94.89 -35.39 12.05 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.794 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.74 36.0 58.39 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.842 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -93.72 152.22 3.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.246 -0.477 . . . . 0.0 111.237 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -120.73 23.59 10.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.035 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.842 ' H ' HG22 ' A' ' 34' ' ' ILE . 10.2 t70 -120.16 74.24 21.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.5 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.551 ' HA ' HD12 ' A' ' 40' ' ' LEU . 66.7 Cg_exo -37.28 -20.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.666 2.244 . . . . 0.0 111.683 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.633 ' O ' ' ND1' ' A' ' 41' ' ' HIS . 0.7 OUTLIER -69.95 -54.0 15.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.549 -179.449 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.923 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -74.42 -26.39 60.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 10.6 mt -63.08 -46.88 85.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.633 ' ND1' ' O ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -67.57 -36.42 80.89 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.796 179.174 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.571 ' N ' ' CD2' ' A' ' 41' ' ' HIS . 4.9 tt0 -51.89 -49.12 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.551 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.049 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -69.29 -56.83 6.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.564 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.816 HD21 HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -45.33 -25.79 0.44 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.407 ' N ' ' C ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -83.78 -49.38 9.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.347 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.422 ' C ' ' H ' ' A' ' 48' ' ' ASN . . . -64.12 -41.98 97.02 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.75 0.309 . . . . 0.0 110.968 -179.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 6.8 p -68.09 4.65 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.809 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 46' ' ' ALA . 3.2 m-80 56.48 33.22 22.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.7 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.79 -23.6 35.27 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' OG ' ' A' ' 47' ' ' SER . 11.7 m-20 -62.45 106.13 0.72 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.649 HG22 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -63.78 -58.4 7.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.691 -179.379 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.649 ' N ' HG22 ' A' ' 51' ' ' ILE . 23.1 m -43.89 -46.19 7.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.122 0.487 . . . . 0.0 110.336 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.662 ' O ' HD12 ' A' ' 57' ' ' LEU . 1.8 mp0 -64.74 -53.54 45.53 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -42.02 -54.02 3.68 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.947 ' O ' HG22 ' A' ' 59' ' ' THR . 69.1 t -46.72 -58.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.126 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -48.86 -46.98 43.13 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.98 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.9 mp -62.27 -34.3 76.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.132 0.491 . . . . 0.0 111.413 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.049 HD21 ' HB2' ' A' ' 43' ' ' ALA . 18.9 mt -87.89 -14.1 40.26 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -177.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.947 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.4 t -132.82 13.06 4.39 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 119.523 -0.871 . . . . 0.0 112.887 -179.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.634 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 7.5 t70 -64.29 14.13 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.106 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.648 ' H ' ' C ' ' A' ' 59' ' ' THR . 14.8 tt0 93.59 63.48 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.062 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.536 ' O ' ' C ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER -146.66 -60.68 0.3 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.019 -178.49 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.708 HG12 ' N ' ' A' ' 64' ' ' LYS . 2.3 t -25.09 -71.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.67 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.708 ' N ' HG12 ' A' ' 63' ' ' VAL . 0.1 OUTLIER 39.79 -172.59 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.109 -179.579 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.483 ' C ' ' O ' ' A' ' 64' ' ' LYS . 27.9 mt-10 -33.57 94.9 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.424 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.498 ' N ' ' O ' ' A' ' 64' ' ' LYS . 16.9 Cg_exo -63.5 -151.69 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.55 0 C-N-CA 122.579 2.186 . . . . 0.0 112.611 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.559 ' O ' ' OG ' ' A' ' 67' ' ' SER . 2.9 p 55.6 64.41 1.76 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.143 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 69' ' ' ASP . 1.6 pp0? -129.1 -30.48 2.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.817 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 3.3 t0 -94.26 -20.25 19.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.162 0.506 . . . . 0.0 110.827 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.576 ' O ' ' O ' ' A' ' 71' ' ' VAL . 30.1 p -96.59 150.95 20.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.446 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.605 ' O ' ' O ' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -32.15 155.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.405 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.605 ' O ' ' O ' ' A' ' 71' ' ' VAL . . . -37.27 -107.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.24 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.535 HG22 ' HD2' ' A' ' 75' ' ' PRO . 0.2 OUTLIER 78.47 -172.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.161 -179.404 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.604 ' H ' ' HD2' ' A' ' 75' ' ' PRO . 2.1 mt-10 -116.45 -53.33 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.308 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.028 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.604 ' HD2' ' H ' ' A' ' 74' ' ' GLU . 84.1 Cg_endo -87.46 -105.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 122.9 2.4 . . . . 0.0 112.142 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.6 t -142.0 178.6 7.41 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.385 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.445 ' OE1' ' OD1' ' A' ' 36' ' ' ASP . 12.4 mt-10 -41.48 -83.44 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.728 0.775 . . . . 0.0 110.407 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 1.039 HG22 ' H ' ' A' ' 79' ' ' GLU . 9.9 p -81.57 -150.67 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.45 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 1.039 ' H ' HG22 ' A' ' 78' ' ' VAL . 0.7 OUTLIER -86.48 154.62 20.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.424 179.837 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 128.74 141.71 5.22 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 82' ' ' ALA . 31.6 m -145.78 -176.57 5.19 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.585 ' O ' ' O ' ' A' ' 81' ' ' SER . . . -53.39 -148.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -46.24 157.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.408 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -86.29 22.29 1.84 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.277 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 86' ' ' GLU . 1.9 pttt -129.03 166.65 18.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.614 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 27.7 tt0 176.71 31.8 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.998 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.606 HG12 ' H ' ' A' ' 89' ' ' ALA . 13.5 t -151.0 154.95 7.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.567 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.563 ' O ' ' O ' ' A' ' 89' ' ' ALA . 4.0 mp -107.75 -25.45 11.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.603 179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.606 ' H ' HG12 ' A' ' 87' ' ' VAL . . . 50.09 118.11 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.969 179.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.624 ' O ' HG23 ' A' ' 91' ' ' VAL . 0.0 OUTLIER -150.83 155.79 39.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.205 -179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 90' ' ' LYS . 72.3 t -161.17 83.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.396 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -87.41 138.09 19.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.47 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -177.78 111.44 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.567 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.954 HD23 ' H ' ' A' ' 94' ' ' LEU . 1.6 pt? -131.66 -48.41 0.97 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.449 0.642 . . . . 0.0 110.934 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.595 ' N ' ' HG ' ' A' ' 94' ' ' LEU . 10.5 t -66.77 139.9 57.82 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.794 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.661 ' NE2' ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER 174.32 -176.39 0.08 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.426 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 43.87 89.14 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.841 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.432 ' OD1' ' N ' ' A' ' 98' ' ' ASN . 11.7 p-10 -97.94 148.94 22.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.187 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 103' ' ' GLN . 3.1 tppt? -141.65 148.92 39.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.235 0.541 . . . . 0.0 111.278 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.422 ' O ' ' CB ' ' A' ' 104' ' ' ALA . 1.9 p30 -59.47 -14.76 13.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.214 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.92 -62.7 1.67 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.925 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.038 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.77 -20.56 30.83 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.845 179.027 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.891 ' N ' HD22 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -68.34 -35.63 78.05 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.931 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.422 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -81.06 -49.66 10.61 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.352 -1.295 . . . . 0.0 110.61 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.92 -42.27 97.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.674 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.0 mm -65.07 -50.04 76.45 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.792 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.436 ' O ' HD13 ' A' ' 111' ' ' LEU . . . -61.08 -47.92 84.1 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.9 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.43 -43.69 88.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.771 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -18.94 38.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.175 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 2.4 tt -87.07 -16.04 36.76 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.424 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 107' ' ' ALA . 1.5 mp -75.84 -19.59 58.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.482 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -118.17 -19.57 8.97 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.778 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.404 ' OG ' ' HD2' ' A' ' 114' ' ' PRO . 0.1 OUTLIER 63.55 162.62 0.12 Allowed Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.697 179.725 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PRO . . . . . 0.404 ' HD2' ' OG ' ' A' ' 113' ' ' SER . 73.0 Cg_exo -43.02 168.16 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.924 2.416 . . . . 0.0 112.547 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.94 -73.13 0.43 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.433 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.87 HG22 ' N ' ' A' ' 117' ' ' GLN . 55.2 mt -116.85 -117.27 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.525 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.87 ' N ' HG22 ' A' ' 116' ' ' ILE . 6.3 pt20 -110.17 31.43 5.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.472 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -75.46 -96.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.618 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.24 -35.72 80.15 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.37 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.788 0 CA-C-O 118.009 -1.439 . . . . 0.0 110.966 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.09 -159.52 1.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.522 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.546 ' O ' ' N ' ' A' ' 5' ' ' LEU . . . -115.75 -57.96 2.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.191 0.519 . . . . 0.0 110.577 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.468 ' C ' ' O ' ' A' ' 3' ' ' ALA . 0.9 OUTLIER -33.37 -33.63 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.372 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.611 HD23 ' N ' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -112.12 -178.64 3.47 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.365 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.61 ' N ' ' CD ' ' A' ' 6' ' ' GLN . 13.1 mp0 -81.62 149.61 28.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.918 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -112.8 -5.27 13.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.371 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 9' ' ' ASP . 1.1 m-20 -100.1 -21.29 15.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.322 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.435 ' C ' ' O ' ' A' ' 8' ' ' ASP . 7.9 t70 -36.65 -63.89 0.38 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.42 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.52 -168.84 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.331 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -158.76 -161.7 1.0 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.814 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.87 -82.31 0.66 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.81 -33.61 24.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.318 0.58 . . . . 0.0 110.562 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 42.83 -148.33 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.456 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -120.61 -86.62 0.65 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.58 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -94.14 -1.11 65.13 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -86.35 114.76 23.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.814 0.34 . . . . 0.0 110.631 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -79.33 -147.22 3.96 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.6 m -138.77 122.36 17.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.89 0.376 . . . . 0.0 110.656 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.2 t -178.36 147.11 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.428 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.88 134.75 36.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.611 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -78.71 -14.74 59.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.474 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.1 mtm -67.31 -23.84 65.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.518 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.488 ' O ' HD11 ' A' ' 51' ' ' ILE . 10.0 mt -66.78 -63.8 0.99 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.982 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.481 HD23 ' H ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -64.85 -34.9 79.46 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.951 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -61.88 -53.36 56.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.085 0.469 . . . . 0.0 110.241 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' GLU . 12.3 mm-40 -55.99 -60.19 3.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.548 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.852 HD23 HD23 ' A' ' 40' ' ' LEU . 15.9 tp -45.42 -49.84 12.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.411 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 1.1 tmt_? -63.27 -20.57 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.161 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 27' ' ' GLN . 4.8 tp10 -84.39 -22.07 30.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.127 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.516 HD12 ' HA ' ' A' ' 28' ' ' LEU . 13.7 mt -92.5 -52.98 9.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.727 0.775 . . . . 0.0 110.72 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.444 ' OG1' HG13 ' A' ' 34' ' ' ILE . 9.7 p -81.76 -36.8 28.12 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.378 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 29' ' ' ARG . . . 79.14 35.78 29.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.703 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -98.57 140.66 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.989 0.423 . . . . 0.0 111.201 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -112.06 22.64 14.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.318 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.703 ' H ' HG22 ' A' ' 34' ' ' ILE . 4.4 t70 -110.67 74.44 0.92 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.979 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -35.88 -25.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.723 2.282 . . . . 0.0 112.393 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -68.9 -53.11 22.94 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 1.056 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -73.17 -24.97 60.62 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.154 0.502 . . . . 0.0 109.652 -179.794 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.852 HD23 HD23 ' A' ' 28' ' ' LEU . 0.6 OUTLIER -69.67 -51.43 34.74 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.625 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -24.97 63.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.94 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -68.31 -39.16 82.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.955 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -68.93 -55.68 10.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.446 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.84 ' CD1' HD22 ' A' ' 28' ' ' LEU . 7.5 mp -53.86 -36.75 62.95 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.25 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -53.99 37.15 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.56 -24.89 50.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.74 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.58 -7.65 49.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 65.88 39.01 4.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.811 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.53 -23.39 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.517 ' C ' ' OD1' ' A' ' 50' ' ' ASP . 16.4 t0 -64.17 93.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.651 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.5 tt -50.59 -57.87 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.143 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.651 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 38.6 m -42.07 -53.46 3.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.98 0.419 . . . . 0.0 110.28 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.656 ' O ' HD12 ' A' ' 57' ' ' LEU . 7.8 mt-30 -57.04 -53.89 52.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.209 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.538 ' HB1' HD12 ' A' ' 44' ' ' LEU . . . -40.38 -57.3 1.81 Allowed 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.615 HG22 HD12 ' A' ' 28' ' ' LEU . 40.3 t -46.62 -60.75 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.856 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -42.39 -49.71 5.17 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.741 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.656 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.3 mp -60.43 -36.66 78.7 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.696 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.056 HD22 ' CE2' ' A' ' 39' ' ' PHE . 11.5 mt -90.84 -11.01 40.61 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.171 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.535 ' C ' ' H ' ' A' ' 61' ' ' GLU . 82.2 p -107.74 -6.33 16.87 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.624 -179.054 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.588 ' C ' ' HE ' ' A' ' 62' ' ' ARG . 0.5 OUTLIER -66.19 38.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.104 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.712 ' C ' ' HE ' ' A' ' 62' ' ' ARG . 26.1 tt0 69.32 75.88 0.23 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.384 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.712 ' HE ' ' C ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -131.07 -97.38 0.34 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.766 179.862 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.93 -38.52 78.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.304 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.0 tptm 72.36 -178.81 0.21 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.032 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -121.14 90.22 47.09 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.836 0.35 . . . . 0.0 110.907 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.567 ' O ' ' O ' ' A' ' 67' ' ' SER . 73.0 Cg_endo -84.37 -155.96 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 123.13 2.553 . . . . 0.0 112.149 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.567 ' O ' ' O ' ' A' ' 66' ' ' PRO . 4.3 p 31.51 -156.69 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.84 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -140.78 -149.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.576 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.612 ' O ' ' O ' ' A' ' 70' ' ' THR . 4.1 m-20 -111.9 -19.21 12.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.979 0.418 . . . . 0.0 110.733 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.612 ' O ' ' O ' ' A' ' 69' ' ' ASP . 64.4 p -15.44 -109.98 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.607 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.436 ' N ' ' OG1' ' A' ' 70' ' ' THR . 7.0 m -140.84 -169.07 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.676 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.543 ' O ' ' C ' ' A' ' 73' ' ' THR . . . -106.04 -31.54 8.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.388 0.613 . . . . 0.0 109.801 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.543 ' C ' ' O ' ' A' ' 72' ' ' ALA . 89.4 m -24.55 -78.2 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.631 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.552 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.6 OUTLIER -127.6 145.19 53.81 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.316 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -69.48 150.42 69.92 Favored 'Trans proline' 0 C--N 1.306 -1.661 0 C-N-CA 122.649 2.233 . . . . 0.0 112.207 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.612 ' O ' ' N ' ' A' ' 78' ' ' VAL . 33.8 t -146.0 34.43 1.01 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.756 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' A' ' 76' ' ' SER . 38.7 mt-10 -32.37 -31.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.11 0.481 . . . . 0.0 110.782 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 1.05 HG13 ' H ' ' A' ' 79' ' ' GLU . 2.6 p -151.91 -91.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.232 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 1.05 ' H ' HG13 ' A' ' 78' ' ' VAL . 59.1 mt-10 -21.48 144.28 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.344 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -169.6 158.37 30.61 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.9 p -116.23 177.43 4.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.929 0.395 . . . . 0.0 110.97 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.38 -111.95 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.001 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.608 ' C ' ' H ' ' A' ' 85' ' ' LYS . . . -147.52 -164.45 2.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.589 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.83 4.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.48 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.608 ' H ' ' C ' ' A' ' 83' ' ' ALA . 8.9 mtpt -72.36 170.91 13.19 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.93 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.578 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 15.3 tt0 -119.66 1.45 11.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.096 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.99 HG12 ' H ' ' A' ' 88' ' ' LEU . 4.5 t -123.45 -174.74 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.496 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.99 ' H ' HG12 ' A' ' 87' ' ' VAL . 30.0 tp -110.25 -30.79 7.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.557 0.694 . . . . 0.0 110.004 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 88' ' ' LEU . . . 80.21 169.43 0.16 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.551 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.468 ' HB2' ' HZ2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -99.09 121.09 40.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 111.028 -179.576 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.651 ' O ' HG13 ' A' ' 91' ' ' VAL . 2.3 p -176.45 27.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.749 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.485 ' C ' ' O ' ' A' ' 91' ' ' VAL . 0.5 OUTLIER -34.38 139.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.341 179.783 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.08 90.91 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.289 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.438 ' HA ' HD22 ' A' ' 94' ' ' LEU . 1.0 OUTLIER -96.97 -90.46 0.26 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.555 -179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.569 ' O ' ' O ' ' A' ' 96' ' ' HIS . 10.0 t -149.63 -138.34 0.09 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.702 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.569 ' O ' ' O ' ' A' ' 95' ' ' THR . 0.3 OUTLIER -48.9 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.357 179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.464 ' O ' ' OD1' ' A' ' 98' ' ' ASN . 4.7 m-20 -146.54 69.59 1.19 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.481 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.533 ' N ' HD12 ' A' ' 102' ' ' LEU . 36.6 m-20 -141.61 145.27 34.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.867 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.528 ' CG ' ' H ' ' A' ' 100' ' ' ASP . 0.8 OUTLIER 80.51 -143.67 0.01 OUTLIER 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.341 0.591 . . . . 0.0 112.098 178.858 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.528 ' H ' ' CG ' ' A' ' 99' ' ' LYS . 0.9 OUTLIER -70.81 -21.77 62.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.015 -179.175 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -55.47 -60.57 3.23 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.834 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.8 HD22 ' N ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -83.5 -24.83 31.55 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.069 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.8 ' N ' HD22 ' A' ' 102' ' ' LEU . 4.9 mt-30 -68.08 -39.89 82.82 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 118.992 -1.083 . . . . 0.0 109.3 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -51.57 9.03 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.744 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.14 78.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 5.4 mm -61.55 -57.98 9.62 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.788 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -51.85 -44.68 63.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 110.921 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.5 tp -59.3 -40.96 87.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.715 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.04 -17.13 36.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.413 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.958 ' O ' HD12 ' A' ' 110' ' ' LEU . 0.9 OUTLIER -89.96 -16.57 29.63 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.687 -179.401 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.66 -24.27 23.96 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.642 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.91 -18.8 49.66 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.888 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.574 ' O ' ' OG ' ' A' ' 113' ' ' SER . 2.0 t 51.0 48.09 5.49 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.251 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 113' ' ' SER . 68.4 Cg_endo -75.09 -170.32 0.77 Allowed 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.844 2.363 . . . . 0.0 112.447 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 8.6 ptmt -112.79 -172.74 2.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.072 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.77 HG22 ' N ' ' A' ' 117' ' ' GLN . 49.0 mt -106.3 -121.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.524 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.77 ' N ' HG22 ' A' ' 116' ' ' ILE . 4.0 tt0 -128.92 20.56 5.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.377 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 40.49 -117.73 0.31 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.549 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -123.21 -92.29 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.523 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.735 0 CA-C-O 118.024 -1.431 . . . . 0.0 110.887 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 mtp . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.03 164.22 24.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.473 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.581 ' O ' ' C ' ' A' ' 4' ' ' GLU . . . -132.47 -113.81 0.23 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.829 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.581 ' C ' ' O ' ' A' ' 3' ' ' ALA . 0.4 OUTLIER 4.04 -83.27 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.71 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.075 HD23 ' H ' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -59.22 -114.12 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.544 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -99.32 -171.51 2.09 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.523 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -124.06 -111.74 0.31 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.034 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -76.75 -22.14 54.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.263 0.554 . . . . 0.0 110.112 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -38.82 -76.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.833 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -145.81 -179.03 6.42 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.677 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -144.76 161.93 38.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.447 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.539 ' O ' ' C ' ' A' ' 13' ' ' ALA . . . 156.31 -132.26 3.26 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.539 ' C ' ' O ' ' A' ' 12' ' ' GLY . . . 27.86 -145.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.705 0.288 . . . . 0.0 110.607 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -97.05 -178.12 4.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.63 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -118.76 -65.3 1.19 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.475 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.06 -79.48 0.18 Allowed Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.44 ' C ' ' H ' ' A' ' 19' ' ' SER . 8.9 t-160 59.34 56.46 3.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.794 0.331 . . . . 0.0 110.657 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.84 -18.59 2.35 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' A' ' 20' ' ' SER . 3.5 p 40.83 -145.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.844 0.354 . . . . 0.0 110.71 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.531 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.6 OUTLIER -84.17 -170.14 2.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.63 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.47 101.26 13.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.366 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.446 ' O ' ' CB ' ' A' ' 26' ' ' ASN . 1.6 tt0 -81.87 -12.91 58.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.074 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 5.2 mtt -63.34 -49.34 74.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.223 0.535 . . . . 0.0 111.425 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.732 HD13 HD12 ' A' ' 51' ' ' ILE . 4.6 mm? -58.11 -61.44 2.55 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.258 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.51 ' CD2' ' H ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -58.7 -48.92 79.48 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.436 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.446 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 48.2 t30 -53.42 -55.25 26.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.22 0.533 . . . . 0.0 110.399 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -56.7 -56.55 19.97 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.158 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.902 HD22 ' CD2' ' A' ' 44' ' ' LEU . 40.8 tp -47.77 -55.99 8.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.696 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -62.1 -25.99 68.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.897 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 29' ' ' ARG . 10.4 mt-10 -76.54 -27.29 55.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.026 0.441 . . . . 0.0 110.375 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.607 HG21 HG11 ' A' ' 55' ' ' VAL . 54.4 mt -85.1 -43.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.787 0.803 . . . . 0.0 110.618 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 28' ' ' LEU . 7.7 p -90.6 -34.73 15.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.469 -178.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 81.71 35.36 22.5 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.761 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -94.95 148.47 5.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.895 0.379 . . . . 0.0 111.007 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -117.83 23.25 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.212 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.761 ' H ' HG22 ' A' ' 34' ' ' ILE . 17.2 m-20 -119.45 72.83 14.74 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.637 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.533 ' HA ' HD12 ' A' ' 40' ' ' LEU . 67.8 Cg_exo -36.37 -20.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.79 2.326 . . . . 0.0 112.036 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -72.51 -53.76 11.15 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.728 -1.123 . . . . 0.0 111.387 -179.245 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.825 ' CZ ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.13 -28.41 64.27 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.609 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 8.5 mt -62.35 -51.97 65.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.7 m80 -59.69 -33.98 72.27 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.721 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -56.32 -47.76 78.08 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.006 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -63.83 -54.24 38.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.732 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.902 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.3 mm? -46.89 -37.36 8.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.866 0.365 . . . . 0.0 110.325 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -80.79 -28.53 36.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.323 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.466 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -77.31 -21.62 53.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.118 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.504 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 59.7 p -101.02 17.78 21.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.77 0.319 . . . . 0.0 110.987 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.504 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.6 OUTLIER 48.89 32.16 3.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.151 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.08 -24.29 31.69 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.451 ' O ' ' OG ' ' A' ' 47' ' ' SER . 25.4 m-20 -65.57 99.7 0.45 Allowed 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.386 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.1 tt -57.58 -56.73 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.864 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.662 ' N ' HG23 ' A' ' 51' ' ' ILE . 55.4 m -43.55 -60.13 1.88 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.021 0.438 . . . . 0.0 110.071 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.563 ' O ' HD12 ' A' ' 57' ' ' LEU . 24.1 mt-30 -50.13 -57.98 6.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.635 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.642 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -38.48 -58.39 1.03 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.978 ' O ' HG22 ' A' ' 59' ' ' THR . 11.0 t -42.69 -57.46 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.091 0 CA-C-N 115.29 -0.868 . . . . 0.0 108.722 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.456 ' N ' ' O ' ' A' ' 53' ' ' GLN . 6.8 t -48.47 -47.32 38.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.359 -1.291 . . . . 0.0 110.919 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.563 HD12 ' O ' ' A' ' 53' ' ' GLN . 4.2 mp -59.65 -36.34 76.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.092 0.472 . . . . 0.0 110.988 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.006 HD21 ' HB2' ' A' ' 43' ' ' ALA . 27.5 mt -81.18 -22.65 38.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.797 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.978 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -114.7 8.43 16.19 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.19 -178.655 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.646 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 11.0 t0 -58.35 15.79 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.469 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.676 ' H ' ' C ' ' A' ' 59' ' ' THR . 2.0 tp10 97.43 58.48 0.0 OUTLIER 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.829 0.347 . . . . 0.0 111.034 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.465 HH11 ' HD3' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -133.47 -84.2 0.45 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.162 0.506 . . . . 0.0 110.693 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.578 ' O ' ' O ' ' A' ' 64' ' ' LYS . 35.6 t -51.21 -85.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.204 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.657 ' NZ ' ' OG1' ' A' ' 59' ' ' THR . 9.7 mtpp 17.59 -138.47 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.384 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.5 ' OE1' ' N ' ' A' ' 65' ' ' GLU . 2.1 mp0 -138.25 86.42 17.13 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.366 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.553 ' O ' ' O ' ' A' ' 67' ' ' SER . 72.7 Cg_endo -81.02 -103.22 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.939 2.426 . . . . 0.0 112.379 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.581 ' O ' ' C ' ' A' ' 68' ' ' GLN . 3.1 t 29.51 96.18 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.394 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.581 ' C ' ' O ' ' A' ' 67' ' ' SER . 0.7 OUTLIER -15.33 -75.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.415 -179.761 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.573 ' O ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -113.22 -39.7 4.09 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.327 0.584 . . . . 0.0 110.994 -179.85 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.573 ' OG1' ' O ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER 166.81 -177.77 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.9 m -132.39 131.78 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.316 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.38 75.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.124 0.487 . . . . 0.0 110.826 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.6 m -170.9 -65.51 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.568 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.61 150.46 1.22 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.14 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.567 ' O ' ' O ' ' A' ' 76' ' ' SER . 25.2 Cg_endo -66.14 165.55 23.89 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.562 2.175 . . . . 0.0 111.975 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.567 ' O ' ' O ' ' A' ' 75' ' ' PRO . 5.7 m -35.15 162.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.704 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -102.8 -78.1 0.55 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.229 0.538 . . . . 0.0 110.323 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.503 HG12 ' H ' ' A' ' 79' ' ' GLU . 2.0 t -67.01 -138.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.474 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.503 ' H ' HG12 ' A' ' 78' ' ' VAL . 12.9 mt-10 -113.37 -94.26 0.46 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.468 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.1 52.37 0.69 Allowed Glycine 0 CA--C 1.526 0.722 0 N-CA-C 111.042 -0.823 . . . . 0.0 111.042 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.0 m -140.49 170.71 15.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.901 0.382 . . . . 0.0 110.797 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.46 ' O ' ' HB2' ' A' ' 83' ' ' ALA . . . -84.68 176.82 8.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.801 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' ALA . . . 174.97 -171.61 0.06 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.444 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -103.7 24.59 10.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.492 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.32 173.17 9.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.604 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.598 ' O ' ' O ' ' A' ' 87' ' ' VAL . 3.6 tt0 67.48 97.32 0.06 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.716 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.598 ' O ' ' O ' ' A' ' 86' ' ' GLU . 2.9 m -25.5 151.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.267 -0.878 . . . . 0.0 111.569 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.16 -33.58 76.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.398 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.435 ' HB2' HG23 ' A' ' 87' ' ' VAL . . . 54.4 173.31 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.983 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.32 -151.41 0.47 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.862 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.565 ' O ' HG13 ' A' ' 91' ' ' VAL . 8.5 p -78.54 44.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.757 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.488 ' O ' HD13 ' A' ' 92' ' ' ILE . 0.1 OUTLIER -52.42 136.42 12.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.95 0.405 . . . . 0.0 110.813 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -154.68 91.63 1.4 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.281 0.562 . . . . 0.0 110.217 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.526 ' HG ' ' H ' ' A' ' 95' ' ' THR . 0.8 OUTLIER -165.37 -51.21 0.03 OUTLIER 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.364 -178.588 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.526 ' H ' ' HG ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -30.2 127.8 0.13 Allowed 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.532 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -105.83 179.67 4.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.726 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.512 ' OD1' ' N ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -116.71 156.2 27.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.712 -179.694 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.71 156.48 18.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.338 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -94.09 -8.01 40.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.764 -179.845 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.491 ' O ' ' HB3' ' A' ' 104' ' ' ALA . 64.2 m-20 -44.29 -18.64 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 99' ' ' LYS . 0.3 OUTLIER -61.52 -58.79 6.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.952 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.877 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.6 pp -79.47 -34.65 41.28 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.212 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.877 ' N ' HD12 ' A' ' 102' ' ' LEU . 2.0 tt0 -62.57 -40.37 96.64 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.813 0.816 . . . . 0.0 109.392 -179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 100' ' ' ASP . . . -79.2 -56.55 4.27 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.889 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.21 -44.67 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.17 0.509 . . . . 0.0 109.834 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.652 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.9 mm -64.63 -53.15 45.83 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.388 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.91 -50.15 73.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.94 0.4 . . . . 0.0 110.605 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.405 ' HA ' HD13 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -55.89 -46.3 78.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.852 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.54 -16.93 53.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.995 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? -89.91 -14.0 35.13 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.556 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -92.17 -18.99 22.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.323 179.354 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -84.17 -34.15 24.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.976 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' ' 114' ' ' PRO . 0.0 OUTLIER -52.07 -55.89 26.79 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.523 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 113' ' ' SER . 62.3 Cg_exo -43.27 152.27 0.26 Allowed 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.619 2.213 . . . . 0.0 111.805 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.447 ' H ' ' CD ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -101.26 -161.31 0.85 Allowed 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.25 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.92 HG22 ' H ' ' A' ' 117' ' ' GLN . 14.9 mt -128.6 -141.28 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.781 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.92 ' H ' HG22 ' A' ' 116' ' ' ILE . 0.2 OUTLIER -79.58 78.26 6.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.568 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -113.34 171.9 7.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.665 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -98.03 -57.31 2.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.566 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.756 0 CA-C-O 118.011 -1.439 . . . . 0.0 110.926 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmm . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.591 ' O ' ' O ' ' A' ' 3' ' ' ALA . 0.6 OUTLIER -119.26 94.97 4.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.564 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.591 ' O ' ' O ' ' A' ' 2' ' ' THR . . . -15.98 -106.39 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.366 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 4' ' ' GLU . 1.2 pt-20 -112.18 166.97 10.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.579 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.966 ' N ' HD22 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -96.85 -129.92 0.17 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.468 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.498 ' C ' ' H ' ' A' ' 8' ' ' ASP . 4.7 tt0 39.45 23.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.867 0.365 . . . . 0.0 110.314 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 5' ' ' LEU . 50.3 tt0 -57.53 -2.49 0.13 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.624 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.498 ' H ' ' C ' ' A' ' 6' ' ' GLN . 1.3 m-20 -92.13 -19.45 22.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.27 0.557 . . . . 0.0 110.379 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -39.24 -68.96 0.14 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.716 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.64 21.2 0.29 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.255 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 8' ' ' ASP . . . -106.55 -103.73 0.34 Allowed 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.411 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 92.92 111.68 2.04 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -109.77 -153.21 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.8 0.333 . . . . 0.0 110.396 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -131.24 -1.52 4.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.471 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -83.64 151.45 25.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.54 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 167.03 124.22 0.7 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -117.01 159.21 22.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.805 0.336 . . . . 0.0 110.722 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -176.42 50.05 0.11 Allowed Glycine 0 CA--C 1.525 0.656 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.3 m -133.44 -152.33 0.48 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.78 0.324 . . . . 0.0 110.563 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.98 105.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.465 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.64 ' O ' ' N ' ' A' ' 23' ' ' MET . 0.0 OUTLIER -81.69 162.73 22.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.461 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -41.73 -14.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.334 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.64 ' N ' ' O ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -61.75 -53.73 52.1 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.101 0.476 . . . . 0.0 110.72 -179.798 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.815 HD13 HD12 ' A' ' 51' ' ' ILE . 3.0 mm? -52.42 -62.75 1.44 Allowed 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.683 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.017 HD22 ' H ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -54.51 -43.83 72.2 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.882 -178.567 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.545 ' O ' ' CB ' ' A' ' 30' ' ' GLU . 47.2 t-20 -69.43 -42.86 74.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.313 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.766 ' O ' HG22 ' A' ' 31' ' ' ILE . 3.9 mm-40 -61.29 -52.83 63.05 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.267 -178.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.84 HD23 ' H ' ' A' ' 29' ' ' ARG . 1.4 pt? -70.68 -48.6 53.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.519 -178.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.84 ' H ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.5 -26.6 67.24 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.526 -179.224 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.545 ' CB ' ' O ' ' A' ' 26' ' ' ASN . 29.5 tp10 -87.87 -57.5 2.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.22 0.533 . . . . 0.0 110.47 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.766 HG22 ' O ' ' A' ' 27' ' ' GLN . 16.4 tt -54.43 -35.46 31.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.672 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.523 HG23 HG23 ' A' ' 31' ' ' ILE . 46.8 p -92.25 -31.28 15.47 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.722 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 70.25 36.31 70.68 Favored Glycine 0 N--CA 1.462 0.394 0 N-CA-C 109.103 -1.599 . . . . 0.0 109.103 -179.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.998 HG22 ' H ' ' A' ' 36' ' ' ASP . 3.8 mm -92.5 152.92 3.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.583 -0.808 . . . . 0.0 112.633 -177.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -122.93 18.75 10.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.483 178.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.998 ' H ' HG22 ' A' ' 34' ' ' ILE . 1.4 m-20 -119.54 65.56 8.92 Favored Pre-proline 0 N--CA 1.455 -0.19 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.61 ' HA ' HD12 ' A' ' 40' ' ' LEU . 70.6 Cg_exo -35.81 -20.33 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.851 0 C-N-CA 122.973 2.448 . . . . 0.0 111.971 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 36' ' ' ASP . 25.2 t -75.33 -52.68 10.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.787 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.727 ' CE1' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.1 -24.15 62.24 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.617 HD22 ' HG ' ' A' ' 28' ' ' LEU . 24.0 mt -66.41 -59.9 3.25 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.337 -1.302 . . . . 0.0 108.917 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.653 ' C ' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -53.89 -40.31 66.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.603 179.51 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -49.88 -48.73 51.23 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.929 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -61.67 -59.94 4.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.498 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.465 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 2.2 mm? -45.27 -24.24 0.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.887 0.375 . . . . 0.0 110.017 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HD3' ' ND1' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -82.64 -42.24 18.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.792 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.6 -24.29 53.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.474 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 84.1 p -84.92 -2.95 58.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.344 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.7 m120 60.73 26.84 16.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.101 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.97 -24.03 31.85 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 121.027 -0.606 . . . . 0.0 111.75 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.16 102.62 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.697 -0.401 . . . . 0.0 109.947 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.815 HD12 HD13 ' A' ' 24' ' ' LEU . 0.8 OUTLIER -58.77 -57.41 11.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.873 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.647 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 25.8 m -41.2 -61.28 1.04 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.197 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.609 ' O ' HD12 ' A' ' 57' ' ' LEU . 72.3 mt-30 -50.58 -55.99 13.78 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.618 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.21 -54.03 3.02 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.951 ' O ' HG22 ' A' ' 59' ' ' THR . 23.4 t -45.57 -59.51 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.221 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.1 t -45.38 -49.24 13.24 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.101 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.609 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.5 mp -63.54 -27.62 69.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.811 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.929 HD21 ' HB2' ' A' ' 43' ' ' ALA . 89.4 mt -91.49 -9.48 44.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.704 -178.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.6 OUTLIER -131.77 6.71 4.36 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.41 -179.116 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.457 ' HB3' ' CZ ' ' A' ' 62' ' ' ARG . 28.8 t0 -67.14 24.09 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.736 179.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.692 ' H ' ' C ' ' A' ' 59' ' ' THR . 3.5 tm-20 78.35 63.27 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.69 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.752 ' C ' ' H ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -121.97 -110.55 0.33 Allowed 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.476 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.554 HG12 ' O ' ' A' ' 63' ' ' VAL . 97.4 t 48.94 -5.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.519 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.752 ' H ' ' C ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -148.02 -139.39 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.474 -179.76 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.494 ' N ' ' CG ' ' A' ' 64' ' ' LYS . 2.5 mm-40 -130.13 78.35 74.84 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.278 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.42 ' O ' ' O ' ' A' ' 65' ' ' GLU . 39.3 Cg_exo -56.51 -142.25 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.813 2.342 . . . . 0.0 112.159 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -145.22 -163.8 1.8 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.567 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.689 ' CD ' ' H ' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -62.62 -14.87 48.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.73 -19.02 5.39 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.178 0.513 . . . . 0.0 110.57 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.2 p -96.8 -118.53 0.12 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.468 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 73' ' ' THR . 1.0 OUTLIER -68.99 134.3 30.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.499 179.931 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -52.51 -32.55 40.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.396 0.617 . . . . 0.0 110.133 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . 1.047 HG22 ' H ' ' A' ' 74' ' ' GLU . 4.2 m -87.51 -166.21 1.52 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.942 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 1.047 ' H ' HG22 ' A' ' 73' ' ' THR . 6.8 tt0 48.2 81.02 0.27 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.78 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.452 ' O ' ' O ' ' A' ' 74' ' ' GLU . 50.6 Cg_exo -48.79 -172.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.754 2.303 . . . . 0.0 111.943 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.448 ' OG ' ' N ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -144.18 -174.53 4.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.887 0.375 . . . . 0.0 110.615 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.448 ' N ' ' OG ' ' A' ' 76' ' ' SER . 41.8 mt-10 -78.54 -76.11 0.21 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.543 0.687 . . . . 0.0 110.594 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 1.014 HG22 ' H ' ' A' ' 79' ' ' GLU . 6.5 p -111.75 -146.53 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.339 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 1.014 ' H ' HG22 ' A' ' 78' ' ' VAL . 83.6 mt-10 -132.11 163.34 28.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.647 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 70.5 102.88 0.04 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.53 -174.16 2.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.683 0.277 . . . . 0.0 110.359 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -43.34 164.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.463 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.473 ' O ' ' C ' ' A' ' 84' ' ' ASN . . . -93.05 -35.12 13.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.298 0.57 . . . . 0.0 110.375 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.473 ' C ' ' O ' ' A' ' 83' ' ' ALA . 1.4 m-80 32.75 76.38 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.667 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -123.65 -176.23 3.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.229 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.92 -9.35 44.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.701 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.8 t -147.04 121.39 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.006 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 88' ' ' LEU . 5.4 mp -87.01 -26.6 23.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.511 0.672 . . . . 0.0 109.298 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.403 ' O ' ' HE3' ' A' ' 90' ' ' LYS . . . 48.85 92.24 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.665 -1.152 . . . . 0.0 111.005 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.654 ' O ' ' N ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -120.66 -164.06 1.07 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.615 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.643 ' O ' HG12 ' A' ' 91' ' ' VAL . 22.0 t 40.52 13.32 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.418 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.654 ' N ' ' O ' ' A' ' 90' ' ' LYS . 2.6 pt -40.55 128.44 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.336 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.684 ' C ' HD12 ' A' ' 94' ' ' LEU . 0.8 OUTLIER -170.29 116.53 0.52 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.95 0.405 . . . . 0.0 110.673 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.684 HD12 ' C ' ' A' ' 93' ' ' ASP . 3.7 mp -154.81 -88.83 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.124 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.975 HG23 ' H ' ' A' ' 96' ' ' HIS . 1.3 t -126.3 -91.17 0.53 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.443 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.975 ' H ' HG23 ' A' ' 95' ' ' THR . 1.7 p80 -104.11 -126.74 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.304 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.553 ' C ' ' O ' ' A' ' 96' ' ' HIS . 1.5 t0 26.22 45.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.765 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.5 ' CG ' ' H ' ' A' ' 99' ' ' LYS . 44.7 t-20 -86.91 -131.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.713 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.5 ' H ' ' CG ' ' A' ' 98' ' ' ASN . 3.5 pttp -84.25 -96.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.159 0.504 . . . . 0.0 110.703 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.462 ' O ' ' CB ' ' A' ' 104' ' ' ALA . 41.4 m-20 -43.83 -20.82 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.521 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' A' ' 99' ' ' LYS . 2.9 t0 -63.07 -58.35 7.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.872 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.063 HD12 ' N ' ' A' ' 103' ' ' GLN . 3.9 pp -78.85 -32.71 46.16 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.085 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 1.063 ' N ' HD12 ' A' ' 102' ' ' LEU . 2.1 tt0 -65.3 -38.86 91.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.761 0.791 . . . . 0.0 109.733 -178.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.462 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -78.79 -49.92 12.19 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.93 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.435 0.636 . . . . 0.0 109.399 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.666 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -63.46 -43.43 98.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.975 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.43 ' O ' HD23 ' A' ' 111' ' ' LEU . . . -68.64 -40.83 80.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.186 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.92 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.58 -20.71 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.183 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.573 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -83.8 -27.83 28.53 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.57 0.7 . . . . 0.0 109.143 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.555 ' O ' ' C ' ' A' ' 112' ' ' GLU . 0.4 OUTLIER -56.61 -85.93 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.823 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.555 ' C ' ' O ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -21.04 -59.75 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.849 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 110' ' ' LEU . 1.2 t -76.89 113.12 27.18 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.21 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.99 -109.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.332 2.021 . . . . 0.0 112.194 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -139.98 -178.95 5.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.753 0.311 . . . . 0.0 110.528 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 1.104 HG23 ' H ' ' A' ' 117' ' ' GLN . 8.6 tt -75.41 -101.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.827 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 1.104 ' H ' HG23 ' A' ' 116' ' ' ILE . 3.2 pt20 -68.39 61.76 0.09 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.732 0.301 . . . . 0.0 110.845 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.583 ' O ' ' O ' ' A' ' 117' ' ' GLN . . . -49.53 -114.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.701 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -125.84 -38.87 2.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.67 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.747 0 CA-C-O 117.922 -1.488 . . . . 0.0 111.087 -179.821 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.508 ' CG ' ' N ' ' A' ' 2' ' ' THR . 1.5 ptp . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.508 ' N ' ' CG ' ' A' ' 1' ' ' MET . 33.0 m -97.73 -51.82 3.96 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.619 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.44 ' C ' ' O ' ' A' ' 2' ' ' THR . . . 36.4 -142.34 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.422 ' O ' ' C ' ' A' ' 5' ' ' LEU . 1.5 tp10 54.1 -162.77 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.777 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' GLU . 1.2 mt 38.12 -142.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.524 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 5' ' ' LEU . 36.8 tt0 37.61 86.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.748 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -70.3 -3.46 17.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.683 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.86 -20.49 42.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.108 0.48 . . . . 0.0 110.49 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.567 ' O ' ' O ' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -72.94 -18.41 61.39 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.355 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.567 ' O ' ' O ' ' A' ' 9' ' ' ASP . . . 39.11 102.81 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.685 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -128.32 34.82 4.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.663 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -106.3 -53.61 0.73 Allowed Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 14' ' ' ALA . . . -97.29 -172.64 2.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.81 0.338 . . . . 0.0 110.593 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 13' ' ' ALA . . . 38.77 -165.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.548 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -155.25 179.15 9.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.496 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 149.02 -70.66 0.32 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.611 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 0.2 OUTLIER -42.11 103.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.797 0.332 . . . . 0.0 110.482 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 169.75 81.18 0.05 OUTLIER Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.497 ' O ' ' OG ' ' A' ' 19' ' ' SER . 4.3 p -131.64 53.97 1.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.879 0.371 . . . . 0.0 110.619 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m 53.63 -175.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.679 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.2 m -123.86 104.83 9.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.497 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.425 ' HG3' ' CE ' ' A' ' 23' ' ' MET . 15.3 pt20 -73.06 -12.5 60.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.838 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.425 ' CE ' ' HG3' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -58.68 -31.31 68.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.128 0.489 . . . . 0.0 110.687 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.417 ' O ' HD11 ' A' ' 51' ' ' ILE . 6.0 mp -62.1 -62.64 1.63 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.083 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.505 ' CD2' ' H ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -64.81 -44.7 89.06 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.9 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -56.52 -59.48 4.92 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.243 0.544 . . . . 0.0 110.865 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -52.4 -50.2 62.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.607 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.796 HD13 ' HB3' ' A' ' 40' ' ' LEU . 5.1 mt -44.76 -59.32 2.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.362 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -69.32 -20.49 63.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.095 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.97 -21.36 40.39 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.788 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.498 HG21 HG11 ' A' ' 55' ' ' VAL . 30.8 mt -98.5 -50.76 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.387 0.613 . . . . 0.0 111.491 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.461 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -85.6 -37.21 19.8 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.492 -178.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.95 36.11 37.1 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.85 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -97.15 154.8 3.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.973 0.416 . . . . 0.0 111.203 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -121.65 23.5 10.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.044 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.85 ' H ' HG22 ' A' ' 34' ' ' ILE . 2.4 t70 -121.98 73.73 36.36 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.366 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.574 ' HA ' HD12 ' A' ' 40' ' ' LEU . 56.2 Cg_exo -36.99 -21.14 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.954 2.436 . . . . 0.0 112.37 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 36' ' ' ASP . 9.3 m -68.57 -54.27 17.68 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.841 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.853 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -75.5 -26.57 58.25 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.796 ' HB3' HD13 ' A' ' 28' ' ' LEU . 10.6 mt -61.31 -60.29 3.97 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.475 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -52.6 -50.75 62.43 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.754 179.361 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 41' ' ' HIS . 25.1 tt0 -40.33 -47.28 2.49 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -60.4 -49.63 76.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.066 178.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.769 ' CD2' HD11 ' A' ' 28' ' ' LEU . 1.0 OUTLIER -58.01 -25.22 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.437 179.671 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 41' ' ' HIS . 11.3 mmmt -79.07 -38.98 35.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.94 0.4 . . . . 0.0 110.433 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.6 -26.62 41.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.106 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.487 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 1.9 p -88.32 10.36 20.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.262 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.0 OUTLIER 49.88 30.78 4.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.723 0.297 . . . . 0.0 110.888 179.624 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.51 -23.42 35.15 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.437 ' O ' ' OG ' ' A' ' 47' ' ' SER . 29.6 t0 -63.03 96.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.029 0.442 . . . . 0.0 110.172 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.62 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.0 OUTLIER -56.35 -52.73 48.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.572 -178.973 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.62 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.4 m -50.82 -46.11 59.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.052 0.453 . . . . 0.0 110.929 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.605 ' O ' HD12 ' A' ' 57' ' ' LEU . 9.2 mm-40 -65.86 -53.56 38.2 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.45 -54.56 3.07 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.824 ' O ' HG22 ' A' ' 59' ' ' THR . 42.6 t -46.62 -57.17 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.757 177.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.55 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 1.4 t -49.39 -45.97 46.73 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.993 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.9 mp -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.853 HD22 ' CE2' ' A' ' 39' ' ' PHE . 79.8 mt -86.16 -23.95 26.36 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.899 -178.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.824 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -125.52 14.5 8.19 Favored 'General case' 0 C--N 1.312 -1.048 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.104 -178.133 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.55 ' OD2' ' O ' ' A' ' 56' ' ' SER . 2.1 m-20 -73.36 24.61 0.07 Allowed 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.141 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.567 ' H ' ' C ' ' A' ' 59' ' ' THR . 2.8 tp10 74.11 66.66 0.09 Allowed 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.044 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.461 ' HD3' ' N ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER -132.98 -53.14 0.91 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.466 -177.658 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.597 ' O ' ' O ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -43.2 -84.43 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.997 -178.596 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.597 ' O ' ' O ' ' A' ' 63' ' ' VAL . 0.1 OUTLIER 28.93 -155.04 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.621 -179.763 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -143.37 78.1 15.06 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-O 121.088 0.471 . . . . 0.0 110.586 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.585 ' O ' ' O ' ' A' ' 67' ' ' SER . 69.5 Cg_endo -86.23 -158.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 123.202 2.601 . . . . 0.0 112.225 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 66' ' ' PRO . 0.1 OUTLIER 42.42 -178.21 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.833 179.786 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.472 ' CG ' ' N ' ' A' ' 69' ' ' ASP . 2.2 tt0 -138.87 -117.4 0.14 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.502 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.472 ' N ' ' CG ' ' A' ' 68' ' ' GLN . 6.9 m-20 -104.56 -19.13 14.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.294 0.569 . . . . 0.0 110.175 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.595 ' O ' HG13 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -162.64 -164.24 0.99 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.338 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.595 HG13 ' O ' ' A' ' 70' ' ' THR . 2.6 m -158.69 139.2 4.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.444 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.538 ' C ' ' OG1' ' A' ' 73' ' ' THR . . . -82.39 -36.76 26.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.186 0.517 . . . . 0.0 110.541 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.538 ' OG1' ' C ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER 171.38 -85.85 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.996 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.764 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -109.02 -15.44 0.13 Allowed Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.969 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.764 ' CD ' ' N ' ' A' ' 74' ' ' GLU . 72.7 Cg_endo -79.74 -107.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.347 0 C-N-CA 121.919 1.746 . . . . 0.0 112.48 -179.272 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.563 ' O ' ' C ' ' A' ' 77' ' ' GLU . 0.4 OUTLIER 36.04 -86.37 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.039 0.447 . . . . 0.0 110.822 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.657 ' N ' ' O ' ' A' ' 75' ' ' PRO . 13.8 mp0 -21.64 -59.64 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.16 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.935 HG12 ' H ' ' A' ' 79' ' ' GLU . 6.5 t -77.61 -141.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.647 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.935 ' H ' HG12 ' A' ' 78' ' ' VAL . 63.2 mt-10 -144.55 -104.47 0.11 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.686 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -136.8 -143.4 4.6 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.1 m -142.36 176.19 9.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.769 0.319 . . . . 0.0 110.636 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -44.3 118.84 1.63 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.778 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.59 -151.45 0.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.627 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 -125.28 18.99 8.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.2 166.8 9.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.43 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 178.51 -26.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.652 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -111.09 153.09 12.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.803 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.448 ' O ' ' HB3' ' A' ' 89' ' ' ALA . 3.6 mm? -63.72 -33.48 75.74 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.685 0.755 . . . . 0.0 110.063 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 88' ' ' LEU . . . 67.26 -179.63 0.22 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 114.425 -1.261 . . . . 0.0 110.619 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.566 ' O ' ' C ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -125.49 -84.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.001 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.773 ' O ' HG22 ' A' ' 91' ' ' VAL . 7.1 p 19.4 53.98 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.112 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.811 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.554 ' O ' ' OD2' ' A' ' 93' ' ' ASP . 10.4 mt 62.61 -122.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.718 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.566 ' O ' ' CG ' ' A' ' 93' ' ' ASP . 0.0 OUTLIER 85.54 104.8 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 121.383 0.611 . . . . 0.0 109.377 -179.415 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.438 ' C ' ' H ' ' A' ' 96' ' ' HIS . 1.3 mt -133.14 -68.23 0.59 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.022 -178.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.458 ' O ' ' OG1' ' A' ' 95' ' ' THR . 0.4 OUTLIER -73.0 13.93 0.34 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.002 -179.637 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.438 ' H ' ' C ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -74.61 154.92 38.33 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.844 0.354 . . . . 0.0 110.689 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.91 108.76 21.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.785 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 177.07 -19.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.448 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -74.36 -78.51 0.1 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.52 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -52.23 -17.58 1.18 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.336 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -61.9 -58.7 6.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.494 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.02 HD12 ' N ' ' A' ' 103' ' ' GLN . 3.6 pp -76.74 -31.12 56.91 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.61 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 1.02 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -64.1 -39.72 94.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.783 0.801 . . . . 0.0 109.486 -178.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.55 -56.39 4.75 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.209 -1.36 . . . . 0.0 110.438 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.47 39.14 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.661 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -50.46 -65.84 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.317 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.02 15.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.55 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.23 -28.68 69.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.666 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.59 -16.65 18.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.043 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.678 HD13 ' O ' ' A' ' 110' ' ' LEU . 0.2 OUTLIER -97.94 -10.47 24.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.552 0.691 . . . . 0.0 109.659 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.642 ' C ' ' H ' ' A' ' 113' ' ' SER . 20.7 mt -128.63 -158.75 0.9 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.254 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.452 ' N ' ' HD2' ' A' ' 114' ' ' PRO . 6.2 tm-20 67.93 -27.69 0.14 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.202 0.525 . . . . 0.0 110.575 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.755 ' N ' ' CD ' ' A' ' 114' ' ' PRO . 0.2 OUTLIER -86.17 -32.91 0.45 Allowed Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.545 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 114' ' ' PRO . . . . . 0.755 ' CD ' ' N ' ' A' ' 113' ' ' SER . 20.9 Cg_endo -82.11 -151.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.731 2.288 . . . . 0.0 111.923 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.7 tptt -115.29 -176.77 2.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.836 0.351 . . . . 0.0 110.834 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 7.0 mt -110.14 -9.83 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.371 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.93 101.02 13.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.766 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 44.42 -143.87 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.859 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -81.9 -42.07 20.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.566 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.75 0 CA-C-O 117.955 -1.469 . . . . 0.0 110.916 -179.952 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.447 ' O ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.477 ' O ' ' O ' ' A' ' 3' ' ' ALA . 12.6 t -66.35 145.33 55.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.611 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' A' ' 2' ' ' THR . . . -50.7 -172.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.546 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.763 ' C ' HD13 ' A' ' 5' ' ' LEU . 9.4 mp0 -62.58 163.04 9.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.445 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.031 ' H ' HD22 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -116.93 171.29 8.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.657 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.598 ' C ' ' H ' ' A' ' 8' ' ' ASP . 24.2 mm-40 -67.61 -64.98 0.75 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.336 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 55.28 -2.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.942 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.598 ' H ' ' C ' ' A' ' 6' ' ' GLN . 2.4 m-20 -109.7 -25.48 10.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.179 0.514 . . . . 0.0 110.759 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -57.02 -28.98 62.98 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.04 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.13 165.98 28.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.632 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -155.6 -25.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.627 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 118.01 -162.49 13.1 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.475 ' O ' ' C ' ' A' ' 14' ' ' ALA . . . -78.78 -156.44 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.72 0.295 . . . . 0.0 110.648 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.475 ' C ' ' O ' ' A' ' 13' ' ' ALA . . . 33.33 -137.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.556 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -70.12 -168.88 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.619 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 126.78 108.38 1.55 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.959 -0.857 . . . . 0.0 110.959 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -116.35 174.64 5.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.8 0.333 . . . . 0.0 110.721 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -128.89 119.11 2.9 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 20' ' ' SER . 53.7 p -104.32 -111.06 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.813 0.34 . . . . 0.0 110.636 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 19' ' ' SER . 0.3 OUTLIER 75.42 -6.0 2.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.423 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.52 ' HB2' HD11 ' A' ' 24' ' ' LEU . 90.2 m -97.18 128.73 44.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.217 179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -81.61 -28.13 33.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.892 -179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -23.17 49.23 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.95 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 21' ' ' CYS . 4.6 mt -69.13 -63.35 1.08 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.276 0.56 . . . . 0.0 110.926 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -33.61 76.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.439 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.48 -56.99 12.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.077 0.465 . . . . 0.0 110.195 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' GLU . 24.3 mm-40 -55.78 -59.87 4.26 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.509 -0.768 . . . . 0.0 109.996 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.918 HD22 ' CD2' ' A' ' 44' ' ' LEU . 10.3 tp -46.6 -51.66 15.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.8 179.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttt180 -63.78 -21.4 66.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.8 tt0 -84.63 -21.91 30.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.579 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.539 HG21 HG11 ' A' ' 55' ' ' VAL . 44.3 mt -94.35 -50.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.493 0.663 . . . . 0.0 111.311 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.517 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.5 p -85.52 -37.83 19.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.397 -178.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.36 36.32 17.67 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.654 HG21 ' CD1' ' A' ' 39' ' ' PHE . 1.1 mm -97.57 143.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.736 0.303 . . . . 0.0 110.351 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -114.89 23.38 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.863 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.645 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -113.83 73.19 2.21 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.338 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -35.11 -24.21 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.938 2.425 . . . . 0.0 112.503 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.2 OUTLIER -71.4 -52.31 19.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.797 179.783 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 1.107 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.19 -28.38 64.18 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.916 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.772 HD23 HD23 ' A' ' 28' ' ' LEU . 1.2 mp -70.3 -48.35 57.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -62.18 -27.25 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.228 178.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -65.19 -48.38 73.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.885 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -62.2 -47.46 84.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.918 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -55.64 -42.58 75.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.189 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.453 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 5.0 tmtt? -74.44 -27.19 60.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.763 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.453 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -79.2 -24.15 43.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.084 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 0.4 OUTLIER -96.2 17.01 16.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.162 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 61.95 22.13 12.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.195 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.78 -23.53 33.55 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -62.96 124.03 20.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.738 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.1 tt -74.72 -55.49 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.077 -179.032 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.632 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.0 m -43.46 -54.19 4.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 0.0 110.169 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.589 ' O ' HD12 ' A' ' 57' ' ' LEU . 79.6 mt-30 -57.73 -54.52 45.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.469 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -40.37 -51.18 2.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.738 HG23 ' O ' ' A' ' 51' ' ' ILE . 18.1 t -50.38 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.024 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.0 t -41.94 -48.31 4.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.286 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.589 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.6 mp -63.09 -29.82 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.934 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.107 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 37.7 mt -89.93 -11.19 42.46 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -177.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.717 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.4 OUTLIER -117.79 -10.27 10.53 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.832 -179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -61.24 -56.16 23.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.315 0.578 . . . . 0.0 110.542 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.474 ' CD ' ' C ' ' A' ' 61' ' ' GLU . 0.4 OUTLIER 178.82 92.21 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.598 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.851 HH11 ' H ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -125.16 -94.11 0.48 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.187 0.518 . . . . 0.0 112.218 -178.6 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.531 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -87.46 -22.22 6.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.829 -178.296 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.851 ' H ' HH11 ' A' ' 62' ' ' ARG . 0.0 OUTLIER -51.83 146.85 7.56 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.477 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.522 ' O ' ' O ' ' A' ' 66' ' ' PRO . 2.1 mt-10 -105.0 102.08 33.71 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.797 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.522 ' O ' ' O ' ' A' ' 65' ' ' GLU . 50.7 Cg_exo -52.2 -131.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.637 2.224 . . . . 0.0 112.194 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 68' ' ' GLN . 43.5 t -179.58 -27.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.876 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.462 ' O ' ' O ' ' A' ' 67' ' ' SER . 3.5 mm100 -51.78 -108.4 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.826 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.17 -17.31 35.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.211 0.529 . . . . 0.0 110.721 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.7 p -100.76 135.99 41.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.69 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.753 HG12 ' N ' ' A' ' 72' ' ' ALA . 39.1 t -141.19 173.98 8.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.771 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.753 ' N ' HG12 ' A' ' 71' ' ' VAL . . . -115.3 -90.73 0.54 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.067 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 m -153.07 -68.8 0.15 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.38 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.734 ' H ' ' CD ' ' A' ' 75' ' ' PRO . 0.8 OUTLIER -110.43 -40.53 0.11 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.7 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.734 ' CD ' ' H ' ' A' ' 74' ' ' GLU . 28.3 Cg_exo -58.38 -172.37 0.05 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.613 2.208 . . . . 0.0 111.939 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.95 -154.38 0.05 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.581 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -47.29 -82.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.19 0.519 . . . . 0.0 110.366 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 79' ' ' GLU . 2.9 t -114.95 -129.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.479 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.47 ' H ' HG12 ' A' ' 78' ' ' VAL . 5.2 mt-10 -123.23 -105.51 0.36 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.583 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -119.18 -96.57 1.7 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 m -120.6 -168.99 1.73 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -42.66 -85.66 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.793 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -95.79 160.21 14.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.457 ' O ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER -155.34 16.16 0.4 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.224 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.457 ' O ' ' O ' ' A' ' 84' ' ' ASN . 0.1 OUTLIER -58.56 -131.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.956 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.438 ' H ' ' CG ' ' A' ' 85' ' ' LYS . 53.4 tt0 -86.09 -17.27 35.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.633 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.571 HG12 ' H ' ' A' ' 89' ' ' ALA . 4.1 t -127.96 140.11 50.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.526 ' H ' HD12 ' A' ' 88' ' ' LEU . 5.0 mp -78.46 -27.77 46.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.135 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.571 ' H ' HG12 ' A' ' 87' ' ' VAL . . . 51.3 178.87 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.421 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.409 ' C ' ' H ' ' A' ' 92' ' ' ILE . 0.2 OUTLIER -138.53 -143.69 0.17 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.916 -179.695 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.569 ' O ' ' C ' ' A' ' 92' ' ' ILE . 2.5 t -73.21 45.86 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.371 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.569 ' C ' ' O ' ' A' ' 91' ' ' VAL . 17.7 pt -19.41 128.43 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.162 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -175.55 110.77 0.11 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.552 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.585 ' CG ' ' H ' ' A' ' 95' ' ' THR . 0.2 OUTLIER -131.2 -80.19 0.53 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.988 -179.158 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.737 ' OG1' ' N ' ' A' ' 96' ' ' HIS . 0.3 OUTLIER 40.22 -160.76 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.136 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.737 ' N ' ' OG1' ' A' ' 95' ' ' THR . 52.6 m80 62.8 164.1 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.713 0.292 . . . . 0.0 110.516 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -113.84 126.85 55.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.15 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.579 ' C ' ' H ' ' A' ' 100' ' ' ASP . 2.4 t-20 61.35 177.38 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.332 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.443 ' C ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER 48.48 6.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.081 179.516 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.579 ' H ' ' C ' ' A' ' 98' ' ' ASN . 42.2 m-20 -50.45 -14.69 0.19 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.889 0.376 . . . . 0.0 110.426 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.443 ' N ' ' C ' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -65.12 -62.99 1.22 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.785 -178.963 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 1.044 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.19 -17.24 46.88 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.717 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.886 ' N ' HD22 ' A' ' 102' ' ' LEU . 1.0 OUTLIER -71.46 -37.16 71.38 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.697 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.84 -49.49 20.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.159 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.46 76.45 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.713 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.5 mm -53.96 -48.17 63.86 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.986 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.12 -34.49 73.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.049 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 tp -69.64 -22.7 63.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.561 ' O ' ' O ' ' A' ' 113' ' ' SER . 0.6 OUTLIER -107.11 -18.93 13.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.56 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 28.5 tp -92.39 -27.06 17.75 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.206 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.37 -24.85 17.21 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.162 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.0 -20.2 17.55 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.816 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 114' ' ' PRO . 0.3 OUTLIER -161.06 171.26 7.22 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.61 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 114' ' ' PRO . . . . . 0.58 ' O ' ' O ' ' A' ' 113' ' ' SER . 50.6 Cg_exo -49.03 -157.66 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.613 2.208 . . . . 0.0 112.019 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.418 ' H ' ' HG2' ' A' ' 115' ' ' LYS . 2.4 ptmt -101.06 -120.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.405 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.566 ' O ' ' N ' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -120.25 155.26 23.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.308 179.864 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.563 ' C ' ' O ' ' A' ' 116' ' ' ILE . 0.0 OUTLIER -21.7 88.25 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.803 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 116' ' ' ILE . . . 40.03 -132.64 0.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.529 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.14 -24.22 5.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.336 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.765 0 CA-C-O 118.014 -1.437 . . . . 0.0 110.832 179.989 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 tpp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.863 HG23 ' O ' ' A' ' 2' ' ' THR . 13.3 t -71.23 79.73 0.71 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.675 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.545 ' C ' ' O ' ' A' ' 2' ' ' THR . . . 29.72 -94.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.93 0.395 . . . . 0.0 109.987 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.639 ' O ' HG23 ' A' ' 2' ' ' THR . 13.2 pm0 -102.06 -138.23 0.34 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.173 179.147 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.692 ' N ' ' CD2' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -178.34 -168.09 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.854 -179.711 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.631 ' O ' ' N ' ' A' ' 8' ' ' ASP . 7.7 tt0 -160.82 31.03 0.15 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.818 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.58 -11.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.939 0.399 . . . . 0.0 110.612 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.631 ' N ' ' O ' ' A' ' 6' ' ' GLN . 0.3 OUTLIER -65.98 -18.9 65.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.289 179.771 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.608 ' CG ' ' H ' ' A' ' 10' ' ' ALA . 5.0 p-10 -50.97 -65.38 0.57 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.019 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.608 ' H ' ' CG ' ' A' ' 9' ' ' ASP . . . -89.63 -170.34 2.8 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.951 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.0 -52.49 0.12 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.518 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 13' ' ' ALA . . . 76.66 106.0 0.14 Allowed Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.564 ' O ' ' C ' ' A' ' 14' ' ' ALA . . . 26.31 -109.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.823 0.344 . . . . 0.0 110.906 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.564 ' C ' ' O ' ' A' ' 13' ' ' ALA . . . -23.4 131.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.856 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -178.29 0.33 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.493 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -52.61 172.97 0.33 Allowed Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -163.09 54.79 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.833 0.349 . . . . 0.0 110.366 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -154.05 99.38 0.19 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 94.9 p -106.94 -27.32 10.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.737 0.303 . . . . 0.0 110.661 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.508 ' OG ' ' N ' ' A' ' 21' ' ' CYS . 0.9 OUTLIER 60.88 -160.28 0.3 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.45 -179.85 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.632 ' O ' ' CD2' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -74.91 111.58 10.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.389 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -14.83 57.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.024 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.589 ' O ' ' OE1' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -69.96 -28.5 65.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.998 0.428 . . . . 0.0 111.199 -179.563 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.807 ' O ' HD12 ' A' ' 28' ' ' LEU . 6.7 mp -71.33 -62.85 1.25 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.406 0.622 . . . . 0.0 110.674 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.081 HD22 ' H ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -58.34 -42.37 86.7 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.395 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -62.57 -56.5 17.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.14 0.495 . . . . 0.0 110.841 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.679 ' OE1' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -49.73 -63.42 1.12 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.494 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.807 HD12 ' O ' ' A' ' 24' ' ' LEU . 1.1 mt -51.84 -51.65 55.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.013 0.435 . . . . 0.0 111.072 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -22.56 46.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.552 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.35 -32.07 22.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.463 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.587 HG21 HG11 ' A' ' 55' ' ' VAL . 62.8 mt -78.9 -55.86 8.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.536 0.684 . . . . 0.0 110.943 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.529 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -78.09 -37.32 46.7 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.762 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.9 36.75 12.68 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -179.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.846 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -98.1 149.43 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.957 0.408 . . . . 0.0 110.851 -179.1 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -119.56 23.37 11.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.155 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.846 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -120.03 69.04 13.47 Favored Pre-proline 0 N--CA 1.453 -0.325 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.982 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -35.51 -20.45 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.864 2.376 . . . . 0.0 112.044 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.671 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.1 OUTLIER -74.76 -53.26 9.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.438 -179.328 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 1.081 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.78 -24.39 63.5 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.72 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.511 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 2.2 mt -67.47 -59.42 3.39 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.749 ' CE1' ' NZ ' ' A' ' 45' ' ' LYS . 1.2 t-80 -53.91 -26.39 24.87 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.814 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -64.95 -47.55 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 1.002 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -64.57 -46.39 82.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.66 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.719 HD21 HD22 ' A' ' 28' ' ' LEU . 4.6 mm? -56.14 -36.86 68.73 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.749 ' NZ ' ' CE1' ' A' ' 41' ' ' HIS . 25.9 mttp -68.93 -46.66 67.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.734 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.6 -22.12 64.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.918 0.39 . . . . 0.0 110.708 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.523 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 62.4 p -90.57 17.6 7.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.489 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.531 ' ND2' ' OD2' ' A' ' 50' ' ' ASP . 0.6 OUTLIER 48.57 30.27 2.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.0 -23.5 35.44 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.531 ' OD2' ' ND2' ' A' ' 48' ' ' ASN . 89.9 m-20 -58.26 115.44 2.95 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.138 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.706 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -69.27 -58.36 5.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.898 -179.255 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.601 ' N ' HG22 ' A' ' 51' ' ' ILE . 22.5 m -45.51 -57.15 4.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.012 0.434 . . . . 0.0 110.575 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.676 ' O ' HD12 ' A' ' 57' ' ' LEU . 75.1 mm-40 -51.51 -59.09 4.64 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.609 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.547 ' HA ' HD13 ' A' ' 57' ' ' LEU . . . -39.03 -54.76 1.66 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.478 0.656 . . . . 0.0 109.338 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.722 ' O ' HG22 ' A' ' 59' ' ' THR . 41.2 t -45.18 -59.19 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.48 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 53' ' ' GLN . 5.0 t -43.93 -49.69 8.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.642 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.2 mp -60.23 -30.31 69.32 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.249 0.547 . . . . 0.0 110.439 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.081 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 41.4 mt -88.07 -14.53 38.66 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.082 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER -122.97 7.8 9.29 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.351 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.637 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -63.29 19.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.124 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.65 ' H ' ' C ' ' A' ' 59' ' ' THR . 20.6 tp10 92.32 55.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.133 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.59 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -128.56 -90.99 0.49 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.204 0.526 . . . . 0.0 110.513 179.829 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.516 ' H ' ' CG ' ' A' ' 62' ' ' ARG . 9.2 t -64.05 -75.74 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.989 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 63' ' ' VAL . 4.2 mtmt 82.88 -158.81 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.496 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.48 ' OE2' ' O ' ' A' ' 32' ' ' THR . 36.0 mt-10 -145.51 153.16 51.12 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.302 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.596 ' O ' ' C ' ' A' ' 67' ' ' SER . 17.2 Cg_exo -52.73 -80.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 121.985 1.79 . . . . 0.0 112.07 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.708 ' O ' ' N ' ' A' ' 70' ' ' THR . 79.9 p 6.11 -105.58 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.794 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.524 ' C ' ' O ' ' A' ' 67' ' ' SER . 78.3 mm-40 -28.83 -49.16 0.07 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.833 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 66' ' ' PRO . 0.9 OUTLIER -63.74 -37.61 88.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.36 0.6 . . . . 0.0 110.789 -179.636 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.708 ' N ' ' O ' ' A' ' 67' ' ' SER . 1.2 p -150.2 138.36 20.32 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.315 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.863 HG22 ' H ' ' A' ' 72' ' ' ALA . 2.3 p -116.11 -152.06 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.902 0.382 . . . . 0.0 110.63 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.863 ' H ' HG22 ' A' ' 71' ' ' VAL . . . -145.82 -83.08 0.14 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.489 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 74' ' ' GLU . 85.5 m -55.69 -103.39 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.514 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.584 ' H ' ' HD2' ' A' ' 75' ' ' PRO . 3.3 mt-10 -136.54 -65.66 0.02 OUTLIER Pre-proline 0 C--N 1.332 -0.189 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.1 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.584 ' HD2' ' H ' ' A' ' 74' ' ' GLU . 28.6 Cg_endo -64.67 -176.17 0.41 Allowed 'Trans proline' 0 N--CA 1.494 1.532 0 C-N-CA 122.335 2.023 . . . . 0.0 112.058 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.01 128.29 41.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.764 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -60.37 -11.54 6.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.475 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.531 HG12 ' N ' ' A' ' 79' ' ' GLU . 8.7 t -135.28 -124.3 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.495 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.531 ' N ' HG12 ' A' ' 78' ' ' VAL . 5.3 pt-20 -113.52 -164.59 0.93 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.588 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -97.81 -178.54 33.54 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.3 m -99.25 167.48 10.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.926 0.394 . . . . 0.0 110.653 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.497 ' O ' ' O ' ' A' ' 83' ' ' ALA . . . -81.26 -86.07 0.09 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.766 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.497 ' O ' ' O ' ' A' ' 82' ' ' ALA . . . 41.46 -169.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.687 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -172.88 -2.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.127 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -67.31 -160.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.398 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.451 ' C ' ' CG2' ' A' ' 87' ' ' VAL . 2.6 tp10 59.44 75.31 0.41 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.442 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.451 ' CG2' ' C ' ' A' ' 86' ' ' GLU . 1.1 t -152.63 125.85 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.123 0.487 . . . . 0.0 111.004 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.648 HD22 ' H ' ' A' ' 88' ' ' LEU . 0.6 OUTLIER -74.84 -28.34 60.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.685 0.755 . . . . 0.0 109.33 179.162 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 64.09 -160.73 0.29 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.522 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.04 148.75 31.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.019 0.438 . . . . 0.0 110.979 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.624 ' O ' HG22 ' A' ' 91' ' ' VAL . 7.6 p -132.98 -1.1 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.278 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.616 HG22 ' N ' ' A' ' 93' ' ' ASP . 41.9 mm 38.5 -100.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.984 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.616 ' N ' HG22 ' A' ' 92' ' ' ILE . 0.8 OUTLIER 167.51 112.54 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.096 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.603 ' O ' ' NE2' ' A' ' 96' ' ' HIS . 2.5 mp -137.92 -87.68 0.26 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.659 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.423 HG22 ' H ' ' A' ' 95' ' ' THR . 1.6 t -64.04 122.03 15.56 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.028 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.603 ' NE2' ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -105.55 -158.82 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.912 179.531 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -108.51 89.16 2.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.158 179.803 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -112.01 -109.63 0.35 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.576 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.578 ' CG ' ' H ' ' A' ' 100' ' ' ASP . 0.9 OUTLIER -126.09 -143.55 0.3 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.73 0.776 . . . . 0.0 113.046 -178.116 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.578 ' H ' ' CG ' ' A' ' 99' ' ' LYS . 2.5 p30 -71.56 -19.79 62.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.968 -179.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -53.38 -60.64 3.04 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.107 -179.924 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.846 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.21 -23.48 30.47 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.871 179.267 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.577 ' N ' HD22 ' A' ' 102' ' ' LEU . 1.1 mt-30 -67.94 -38.4 82.78 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 118.985 -1.086 . . . . 0.0 108.953 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.74 -51.98 9.03 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.689 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.62 -44.44 85.52 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.425 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -64.47 -43.87 96.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.038 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.27 -53.14 53.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.978 0.418 . . . . 0.0 110.793 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.74 HD23 ' O ' ' A' ' 108' ' ' LEU . 2.7 tt -54.77 -43.54 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.751 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.446 ' O ' ' N ' ' A' ' 113' ' ' SER . 0.5 OUTLIER -84.61 -19.85 32.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.47 -179.33 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.584 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 3.7 tt -82.11 -19.31 40.35 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.103 0.478 . . . . 0.0 109.787 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.0 tp -62.24 -21.37 65.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.39 178.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -130.99 -57.61 1.03 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.134 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.446 ' N ' ' O ' ' A' ' 109' ' ' SER . 4.8 t 40.35 88.0 0.1 Allowed Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.028 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -65.94 -80.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 123.013 2.476 . . . . 0.0 111.867 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -111.6 -140.22 0.38 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.614 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.55 ' O ' ' C ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -115.98 155.35 17.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.31 179.814 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.55 ' C ' ' O ' ' A' ' 116' ' ' ILE . 11.9 pt20 24.29 94.12 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.948 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -125.42 173.17 9.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.564 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -141.96 -77.87 0.26 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.677 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.745 0 CA-C-O 117.988 -1.451 . . . . 0.0 110.952 -179.924 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HB2' HD11 ' A' ' 51' ' ' ILE . 1.7 mm100 . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.501 HD23 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -45.62 -51.62 11.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.065 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 29' ' ' ARG . 1.7 mtp180 -64.06 -22.23 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.617 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 27' ' ' GLN . 45.0 mt-10 -85.46 -20.2 30.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.847 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.7 HD13 HG21 ' A' ' 55' ' ' VAL . 16.6 mt -93.83 -50.84 11.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.575 0.702 . . . . 0.0 111.396 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.531 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 1.6 p -92.69 -38.0 12.08 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.143 -177.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.42 35.97 35.58 Favored Glycine 0 CA--C 1.522 0.5 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.697 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -90.81 150.5 3.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.054 0.454 . . . . 0.0 111.057 -179.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.423 ' H ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -114.38 23.74 12.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.988 -179.113 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.697 ' H ' HG22 ' A' ' 34' ' ' ILE . 40.1 t0 -120.64 74.37 24.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.156 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -36.07 -25.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.929 2.419 . . . . 0.0 112.177 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -73.13 -51.62 17.28 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.09 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.925 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.31 -27.44 64.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -69.45 -55.94 8.84 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.311 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -58.14 -25.17 61.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.386 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -66.29 -49.1 68.23 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.915 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -58.14 -44.85 88.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.248 179.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.501 HD21 HD23 ' A' ' 28' ' ' LEU . 3.7 mm? -63.05 -34.0 76.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.011 0.434 . . . . 0.0 110.097 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 1.4 tmtm? -72.9 -30.8 64.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.033 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.454 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.42 -28.79 28.61 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.245 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.709 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 1.1 m -84.5 3.59 35.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.423 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m120 68.54 21.31 8.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.166 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.66 0.35 49.43 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.479 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.28 130.57 34.55 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.139 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.562 HG22 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -78.01 -52.2 16.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.512 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.562 ' N ' HG22 ' A' ' 51' ' ' ILE . 28.5 m -52.26 -53.2 46.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 111.268 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.487 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 mm-40 -59.39 -56.77 17.84 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.427 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.709 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -41.69 -57.31 2.34 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-O 122.193 0.997 . . . . 0.0 108.593 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.7 HG21 HD13 ' A' ' 31' ' ' ILE . 2.1 t -43.02 -57.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.454 -1.703 . . . . 0.0 108.324 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.453 ' N ' HG12 ' A' ' 55' ' ' VAL . 2.7 t -46.73 -52.94 12.85 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.164 178.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 13.7 mt -50.18 -38.97 42.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.219 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.925 HD22 ' CE2' ' A' ' 39' ' ' PHE . 21.0 mt -81.03 -53.81 6.1 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.123 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.675 HG23 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.683 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.234 0.285 0 CA-C-O 120.799 0.333 . . . . 0.0 110.879 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.697 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.1 pp -82.11 -30.31 31.27 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.697 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.6 0.714 . . . . 0.0 109.881 -178.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -80.94 -48.48 12.24 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.232 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.78 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.693 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -65.63 -42.72 93.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.838 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.12 -48.2 68.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.966 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -38.56 83.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.66 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -20.7 25.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 111.461 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.557 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 23.1 tp . . . . . 0 C--N 1.32 -0.698 0 CA-C-O 121.537 0.684 . . . . 0.0 109.459 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.406 ' HB3' HD13 ' A' ' 51' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.101 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.838 HD22 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -53.26 -51.65 61.57 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.302 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -23.01 63.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.631 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.29 -44.12 16.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.546 HG21 HG11 ' A' ' 55' ' ' VAL . 63.1 mt -69.81 -54.78 17.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.416 0.627 . . . . 0.0 111.438 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.511 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 4.7 p -76.13 -36.59 58.75 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.553 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.2 36.15 60.24 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.957 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.7 mm -90.62 151.29 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.173 0.511 . . . . 0.0 111.703 -178.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -119.33 23.26 11.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.707 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.957 ' H ' HG22 ' A' ' 34' ' ' ILE . 46.5 t0 -120.37 69.92 15.85 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.212 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HA ' HD12 ' A' ' 40' ' ' LEU . 83.1 Cg_exo -36.94 -21.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.753 2.302 . . . . 0.0 111.707 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -75.41 -52.74 10.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.356 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.762 ' CE1' HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.22 -26.23 64.71 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.587 HD22 HD12 ' A' ' 28' ' ' LEU . 14.1 mt -66.33 -55.93 13.6 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -50.85 -37.18 41.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.598 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -58.22 -45.37 87.81 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -58.26 -54.11 50.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.027 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.838 HD21 HD22 ' A' ' 28' ' ' LEU . 3.8 mm? -62.64 -20.22 64.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.278 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -79.01 -54.13 6.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.973 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.26 -29.48 69.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 4.0 p -76.15 -16.75 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m120 68.24 33.37 4.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.498 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.48 -20.97 42.63 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 47' ' ' SER . 36.0 m-20 -68.53 118.46 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.832 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.1 OUTLIER -74.18 -53.17 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.52 -179.726 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.611 ' N ' HG22 ' A' ' 51' ' ' ILE . 39.3 m -45.76 -55.52 6.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.344 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.35 -57.35 11.6 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.674 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.86 -47.65 4.26 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 109.785 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.985 ' O ' HG22 ' A' ' 59' ' ' THR . 24.6 t -53.95 -59.75 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.817 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -54.59 -44.82 73.37 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.806 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 54' ' ' ALA . 10.3 mt -58.09 -36.23 72.56 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.485 0.66 . . . . 0.0 110.893 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.762 HD23 ' CE1' ' A' ' 39' ' ' PHE . 7.2 mp -84.35 -40.23 18.14 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.787 -1.097 . . . . 0.0 113.268 -177.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.985 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.5 t . . . . . 0 C--N 1.318 -0.802 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.84 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.237 0.403 0 CA-C-O 120.635 0.255 . . . . 0.0 111.091 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.083 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.95 -19.71 36.65 Favored 'General case' 0 C--O 1.216 -0.666 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.442 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.908 ' N ' HD22 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -67.77 -36.69 80.95 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.504 -0.879 . . . . 0.0 108.769 179.041 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.34 -52.36 8.21 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.516 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.57 -45.5 85.11 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.679 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.1 mm -62.73 -45.8 97.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.988 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.06 91.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.247 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.26 -40.53 94.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.843 0.354 . . . . 0.0 110.346 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -18.02 32.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.902 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 1.001 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.2 tm? . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.62 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.863 0.364 . . . . 0.0 110.489 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.637 ' HB3' HD23 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -45.49 -55.78 5.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.803 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -67.31 -20.94 65.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.61 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -80.75 -24.14 38.9 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.449 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.576 HG21 HG11 ' A' ' 55' ' ' VAL . 46.2 mt -95.8 -54.83 6.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.571 0.7 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.441 ' OG1' HG13 ' A' ' 34' ' ' ILE . 5.8 p -78.88 -37.92 38.94 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.78 -178.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.79 36.04 30.02 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.746 HD12 ' CZ ' ' A' ' 39' ' ' PHE . 1.1 mm -98.74 144.78 11.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.789 0.328 . . . . 0.0 110.964 -179.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.522 ' OE1' ' N ' ' A' ' 35' ' ' GLN . 3.3 mp0 -113.35 22.7 13.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.658 ' H ' HG22 ' A' ' 34' ' ' ILE . 1.5 m-20 -111.46 71.6 0.89 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.354 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' CG ' ' A' ' 41' ' ' HIS . 78.2 Cg_exo -35.31 -22.71 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.752 2.301 . . . . 0.0 111.92 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.638 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -74.06 -49.59 23.41 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.869 179.881 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.821 ' CE1' HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -73.92 -29.83 62.25 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.648 HD12 ' O ' ' A' ' 36' ' ' ASP . 1.7 mp -69.96 -49.81 48.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.462 -0.79 . . . . 0.0 108.87 177.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.442 ' CG ' ' O ' ' A' ' 37' ' ' PRO . 18.5 m170 -67.06 -24.02 65.93 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.464 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -68.17 -39.02 82.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.752 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -63.87 -50.12 70.06 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.963 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.597 HD21 HD12 ' A' ' 28' ' ' LEU . 81.7 mt -65.4 -24.38 67.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.942 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.8 -31.2 45.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.174 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.9 -35.6 26.01 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.928 0.394 . . . . 0.0 110.076 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.57 ' O ' ' OD1' ' A' ' 48' ' ' ASN . 72.3 p -84.28 12.55 6.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.705 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 47' ' ' SER . 24.0 p30 47.4 37.98 6.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.778 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.36 -24.0 32.42 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.244 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.09 104.46 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 117.267 0.534 . . . . 0.0 109.981 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.645 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.3 OUTLIER -60.77 -55.58 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.183 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.645 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.9 m -40.88 -57.55 1.93 Allowed 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.322 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 54' ' ' ALA . 8.6 mt-30 -51.18 -55.01 20.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.696 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.824 ' HA ' HD12 ' A' ' 57' ' ' LEU . . . -41.75 -44.63 3.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.46 0.648 . . . . 0.0 109.704 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.946 ' O ' HG22 ' A' ' 59' ' ' THR . 13.7 t -59.22 -59.6 3.61 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.75 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.3 t -52.95 -38.15 61.77 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.593 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 54' ' ' ALA . 8.7 mt -67.34 -40.56 85.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.264 0.554 . . . . 0.0 111.285 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.821 HD23 ' CE1' ' A' ' 39' ' ' PHE . 6.9 mp -80.37 -38.98 29.37 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.682 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.946 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.3 t . . . . . 0 C--N 1.317 -0.841 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.756 -178.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.285 0 CA-C-O 120.458 0.17 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.117 HD23 ' N ' ' A' ' 103' ' ' GLN . 0.5 OUTLIER -83.23 -28.83 28.94 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.486 179.458 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 1.117 ' N ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.26 -39.03 93.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.912 0.863 . . . . 0.0 109.364 -179.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -80.31 -54.64 5.54 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.141 -1.39 . . . . 0.0 111.169 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.41 -44.34 76.13 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.351 0.596 . . . . 0.0 109.471 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.668 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -67.37 -41.86 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.364 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.51 89.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -38.97 89.6 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.178 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.65 -18.04 34.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.098 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 1.028 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.791 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 110.621 -0.14 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.751 ' HB2' HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -52.6 -55.08 24.86 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.594 -179.386 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.426 ' CD ' ' C ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -63.54 -21.63 66.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.352 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -87.64 -20.32 26.5 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.462 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.0 mt -97.43 -53.53 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-O 121.529 0.68 . . . . 0.0 111.085 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.516 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.1 p -77.85 -36.65 49.69 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.95 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.2 35.78 52.33 Favored Glycine 0 CA--C 1.519 0.288 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.919 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.8 mm -92.72 155.64 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.118 0.485 . . . . 0.0 111.68 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.43 ' N ' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -118.9 23.2 11.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.41 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.919 ' H ' HG22 ' A' ' 34' ' ' ILE . 4.5 m-20 -125.27 75.94 68.3 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.979 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.559 ' HA ' HD12 ' A' ' 40' ' ' LEU . 85.6 Cg_exo -39.26 -20.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.597 2.198 . . . . 0.0 111.563 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.575 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -73.67 -53.89 9.37 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.676 -179.407 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.986 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.94 -25.6 62.81 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.569 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.751 HD22 ' HB2' ' A' ' 28' ' ' LEU . 9.6 mt -64.74 -54.68 27.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.457 ' CD2' ' O ' ' A' ' 41' ' ' HIS . 5.6 t-160 -57.81 -30.59 65.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.088 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.18 -44.35 95.63 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.025 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -65.82 -42.36 90.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.259 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.632 ' CD2' HD13 ' A' ' 28' ' ' LEU . 4.4 mm? -62.5 -31.97 72.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.146 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.31 -29.39 34.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.183 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.44 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -77.45 -42.48 35.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.393 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.633 ' OG ' ' HB2' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -72.41 14.13 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.653 0.263 . . . . 0.0 111.007 -179.39 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.691 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.7 OUTLIER 60.42 26.32 15.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.473 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.27 -23.38 34.54 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.48 127.52 31.9 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.595 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.4 OUTLIER -77.56 -57.63 5.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.125 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.595 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 14.4 m -47.84 -45.98 30.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.065 0.46 . . . . 0.0 110.506 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 41.8 mt-30 -61.71 -55.8 26.46 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.633 ' HB2' ' OG ' ' A' ' 47' ' ' SER . . . -41.47 -58.29 1.94 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.139 0.971 . . . . 0.0 108.511 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.881 ' O ' HG22 ' A' ' 59' ' ' THR . 18.1 t -43.56 -54.38 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.754 178.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.5 t -52.43 -44.95 65.74 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.612 178.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 16.9 mt -57.45 -34.59 69.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.26 0.552 . . . . 0.0 110.888 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.025 HD21 ' HB2' ' A' ' 43' ' ' ALA . 13.8 mt -87.84 -26.89 22.57 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -177.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.881 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.677 0 C-N-CA 120.094 -0.643 . . . . 0.0 111.26 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.0 t70 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.504 0.193 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.108 HD23 ' N ' ' A' ' 103' ' ' GLN . 0.4 OUTLIER -83.42 -29.04 28.43 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 120.244 -0.582 . . . . 0.0 110.705 179.786 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 1.108 ' N ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -64.4 -40.72 96.34 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.529 -0.869 . . . . 0.0 109.341 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -55.59 4.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.919 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.88 -46.61 71.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.159 0.504 . . . . 0.0 109.669 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.686 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.3 mm -62.58 -47.93 90.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.996 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.29 98.58 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.223 -178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -41.02 98.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -18.37 36.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.091 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.994 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.2 tm? . . . . . 0 C--N 1.32 -0.683 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.528 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' N ' ' A' ' 30' ' ' GLU . 2.6 mm-40 . . . . . 0 CA--C 1.522 -0.119 0 CA-C-O 121.038 0.447 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.962 HD22 ' CD2' ' A' ' 44' ' ' LEU . 12.4 tp -44.68 -54.27 6.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.97 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -63.03 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.374 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 27' ' ' GLN . 29.6 tt0 -79.29 -21.21 46.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.998 0.428 . . . . 0.0 110.398 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.448 HG21 HG11 ' A' ' 55' ' ' VAL . 59.4 mt -93.96 -44.29 13.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.383 0.611 . . . . 0.0 111.215 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.533 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.1 p -91.44 -37.45 13.18 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.312 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.99 34.77 10.48 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.64 HG21 ' CD1' ' A' ' 39' ' ' PHE . 1.1 mm -100.09 142.27 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.773 0.321 . . . . 0.0 110.39 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -113.85 23.29 13.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.792 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.635 ' O ' ' N ' ' A' ' 38' ' ' SER . 36.4 t0 -112.52 72.51 1.31 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -34.96 -22.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.691 0 C-N-CA 122.877 2.385 . . . . 0.0 112.336 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.635 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.8 OUTLIER -73.68 -52.66 12.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.938 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 1.075 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -72.26 -26.01 61.83 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.643 HD23 HD23 ' A' ' 28' ' ' LEU . 1.2 mp -71.91 -53.17 13.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -60.72 -24.92 66.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.128 178.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -65.79 -46.11 79.93 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.922 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -61.53 -51.52 68.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.071 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.962 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.3 mm? -55.04 -36.27 65.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.207 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 4.4 tmtt? -76.54 -28.74 56.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.446 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.469 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.32 -20.88 33.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.914 0.388 . . . . 0.0 110.735 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.42 ' OG ' ' HB2' ' A' ' 53' ' ' GLN . 42.2 t -93.02 -6.83 47.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.381 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.695 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.2 OUTLIER 74.75 26.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.055 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.12 -21.59 41.07 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.35 123.64 20.93 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.73 ' O ' HG23 ' A' ' 55' ' ' VAL . 2.2 tt -75.56 -56.03 9.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.036 -179.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.639 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.2 m -46.09 -52.34 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.809 0.337 . . . . 0.0 110.662 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.615 ' O ' HD12 ' A' ' 57' ' ' LEU . 28.1 mt-30 -59.64 -53.68 55.23 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.37 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.0 -53.52 2.95 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.855 ' O ' HG22 ' A' ' 59' ' ' THR . 39.5 t -47.73 -58.73 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.949 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.2 t -46.02 -48.53 16.74 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.249 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.615 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.6 mp -62.53 -27.64 69.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.199 0.523 . . . . 0.0 111.02 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.075 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 52.6 mt -90.31 -14.02 34.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.853 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.855 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.568 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.329 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 C--O 1.236 0.345 0 CA-C-O 120.604 0.24 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.906 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -81.39 -22.52 38.24 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.73 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.889 ' N ' HD22 ' A' ' 102' ' ' LEU . 6.4 mt-30 -66.71 -40.84 88.61 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.677 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.95 -53.22 9.37 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.362 -1.29 . . . . 0.0 111.026 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.68 -51.52 68.43 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.663 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -55.38 -45.01 77.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.938 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.89 -31.04 69.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.136 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -28.0 63.27 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.013 0.435 . . . . 0.0 109.854 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.7 -18.66 16.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 106' ' ' ILE . 4.7 tt . . . . . 0 C--N 1.32 -0.679 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.571 -178.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.146 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.88 HD23 HD23 ' A' ' 40' ' ' LEU . 11.1 tp -46.45 -51.86 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.554 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -60.91 -21.29 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.437 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.467 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.3 tt0 -86.43 -24.25 25.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.48 HD12 ' HA ' ' A' ' 28' ' ' LEU . 31.3 mt -87.26 -53.35 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 CA-C-O 121.889 0.852 . . . . 0.0 110.537 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.496 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.7 p -82.63 -37.29 25.16 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.048 -1.433 . . . . 0.0 111.675 -178.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.28 35.34 17.96 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.694 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -99.41 142.42 15.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.893 0.378 . . . . 0.0 110.827 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -112.96 23.35 13.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.46 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.694 ' H ' HG22 ' A' ' 34' ' ' ILE . 15.2 m-20 -112.39 73.94 1.46 Allowed Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.441 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -35.36 -24.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.605 2.203 . . . . 0.0 112.021 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.611 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -71.88 -52.98 14.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.258 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 1.032 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.99 -25.21 62.6 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.766 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.88 HD23 HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -71.84 -47.84 50.27 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.771 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -65.26 -26.96 68.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.123 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.51 -53.77 42.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.903 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -59.69 -38.37 81.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.261 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.75 ' CD2' HD22 ' A' ' 28' ' ' LEU . 3.3 mm? -67.36 -30.12 69.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.934 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -77.26 -33.94 55.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.11 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.489 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -81.86 -37.9 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.749 -179.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 48' ' ' ASN . 32.0 p -67.53 -12.75 61.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.757 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.411 ' CB ' ' O ' ' A' ' 47' ' ' SER . 0.2 OUTLIER 74.03 37.79 0.61 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.83 -23.58 30.25 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -67.71 125.61 26.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.833 0.349 . . . . 0.0 110.281 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.633 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.6 OUTLIER -78.02 -57.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -179.636 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.633 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 18.5 m -45.39 -53.04 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.937 0.399 . . . . 0.0 110.568 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.68 ' O ' HD12 ' A' ' 57' ' ' LEU . 44.9 mt-30 -55.69 -55.33 33.47 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.283 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.412 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.33 -54.04 3.12 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.586 0.708 . . . . 0.0 109.149 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.635 ' O ' HG22 ' A' ' 59' ' ' THR . 61.6 t -47.57 -56.96 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.635 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -51.28 -46.67 62.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.306 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.68 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.1 mp -60.2 -34.54 73.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 0.0 111.327 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.032 HD22 ' CE2' ' A' ' 39' ' ' PHE . 18.8 mt -81.44 -58.18 3.14 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.428 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.773 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.672 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.0 t70 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.677 0.275 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.961 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.5 pp -76.25 -32.03 58.66 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.364 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.961 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.9 OUTLIER -63.41 -38.49 91.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.724 0.774 . . . . 0.0 109.508 -179.028 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.51 -56.41 4.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.595 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.64 -55.02 29.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.667 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.6 mm -51.89 -52.96 19.72 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.754 179.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.86 73.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.057 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.774 HD23 ' O ' ' A' ' 108' ' ' LEU . 8.6 tt -58.18 -32.52 68.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.884 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.06 -18.14 22.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.984 0.421 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.981 ' O ' HD12 ' A' ' 110' ' ' LEU . 1.1 tp . . . . . 0 C--N 1.319 -0.751 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.71 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.756 0.312 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.756 HD13 HD21 ' A' ' 44' ' ' LEU . 6.6 tp -52.88 -57.93 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.908 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -59.4 -21.52 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.29 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.2 -35.01 25.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.826 0.346 . . . . 0.0 110.769 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.612 HG21 HG11 ' A' ' 55' ' ' VAL . 38.6 mt -73.0 -52.41 22.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-O 121.659 0.743 . . . . 0.0 110.684 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.477 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.0 p -79.74 -35.32 39.02 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.609 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 67.28 36.15 89.11 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.812 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -89.32 155.71 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.256 -0.472 . . . . 0.0 111.705 -178.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -122.26 23.35 9.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.608 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.812 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -119.77 70.09 13.41 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -34.83 -20.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.962 2.441 . . . . 0.0 112.221 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.669 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -73.73 -52.43 13.23 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.632 179.66 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.953 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.33 -25.38 64.18 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.514 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mt -69.61 -59.79 2.74 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.723 ' HD1' ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -57.51 -27.57 62.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.447 179.136 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.723 ' N ' ' HD1' ' A' ' 41' ' ' HIS . 62.9 tt0 -61.3 -56.77 16.74 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.67 179.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.935 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -58.56 -38.7 78.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.756 HD21 HD13 ' A' ' 28' ' ' LEU . 2.0 mm? -67.59 -24.9 65.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.96 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.449 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.43 -30.59 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.179 179.237 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.449 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -82.07 -36.95 27.12 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.813 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.584 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 41.4 t -72.58 -16.24 61.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 73.6 36.38 0.78 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.956 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.66 -23.69 35.13 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.584 ' O ' ' OG ' ' A' ' 47' ' ' SER . 0.4 OUTLIER -66.97 116.08 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.943 ' O ' HG23 ' A' ' 55' ' ' VAL . 1.7 tt -70.15 -50.88 43.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.408 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.638 ' N ' HG23 ' A' ' 51' ' ' ILE . 54.4 m -50.87 -61.44 2.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.289 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.721 ' O ' HD12 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -49.85 -56.24 11.19 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.887 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.05 -55.18 2.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.943 HG23 ' O ' ' A' ' 51' ' ' ILE . 21.4 t -47.24 -58.57 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.746 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.6 t -48.47 -50.08 32.97 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.721 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.0 mp -55.4 -36.78 66.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.196 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.953 HD22 ' CE2' ' A' ' 39' ' ' PHE . 25.5 mt -80.5 -62.21 1.74 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.941 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.647 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.314 -0.956 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.542 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.008 HD23 ' H ' ' A' ' 103' ' ' GLN . 0.9 OUTLIER -77.18 -34.76 56.25 Favored 'General case' 0 C--O 1.21 -0.976 0 C-N-CA 120.304 -0.559 . . . . 0.0 112.425 -178.441 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 1.008 ' H ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -63.22 -35.66 81.08 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.806 0.812 . . . . 0.0 109.561 -178.766 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.68 -56.57 4.2 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.442 -1.253 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.62 -47.7 73.12 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.518 0.675 . . . . 0.0 109.289 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.675 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.8 mm -61.08 -46.72 96.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.612 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.771 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 103' ' ' GLN . . . -60.39 -45.7 92.62 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.85 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.3 tp -59.62 -43.33 93.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.647 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.0 -19.17 34.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.245 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.963 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 . . . . . 0 CA--C 1.527 0.082 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.816 HD22 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -51.33 -48.72 62.33 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 119.807 -0.757 . . . . 0.0 110.479 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.75 -22.35 65.23 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.141 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -85.86 -20.86 28.48 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.981 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 94.1 mt -94.49 -38.8 9.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-O 121.6 0.714 . . . . 0.0 110.927 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 28' ' ' LEU . 11.4 p -94.89 -35.39 12.05 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.794 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.74 36.0 58.39 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.842 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -93.72 152.22 3.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.246 -0.477 . . . . 0.0 111.237 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -120.73 23.59 10.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.035 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.842 ' H ' HG22 ' A' ' 34' ' ' ILE . 10.2 t70 -120.16 74.24 21.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.5 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.551 ' HA ' HD12 ' A' ' 40' ' ' LEU . 66.7 Cg_exo -37.28 -20.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.666 2.244 . . . . 0.0 111.683 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.633 ' O ' ' ND1' ' A' ' 41' ' ' HIS . 0.7 OUTLIER -69.95 -54.0 15.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.549 -179.449 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.923 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -74.42 -26.39 60.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 10.6 mt -63.08 -46.88 85.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.633 ' ND1' ' O ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -67.57 -36.42 80.89 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.796 179.174 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.571 ' N ' ' CD2' ' A' ' 41' ' ' HIS . 4.9 tt0 -51.89 -49.12 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.551 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.049 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -69.29 -56.83 6.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.564 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.816 HD21 HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -45.33 -25.79 0.44 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.407 ' N ' ' C ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -83.78 -49.38 9.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.347 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.422 ' C ' ' H ' ' A' ' 48' ' ' ASN . . . -64.12 -41.98 97.02 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.75 0.309 . . . . 0.0 110.968 -179.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 6.8 p -68.09 4.65 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.809 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 46' ' ' ALA . 3.2 m-80 56.48 33.22 22.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.7 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.79 -23.6 35.27 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' OG ' ' A' ' 47' ' ' SER . 11.7 m-20 -62.45 106.13 0.72 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.649 HG22 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -63.78 -58.4 7.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.691 -179.379 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.649 ' N ' HG22 ' A' ' 51' ' ' ILE . 23.1 m -43.89 -46.19 7.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.122 0.487 . . . . 0.0 110.336 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.662 ' O ' HD12 ' A' ' 57' ' ' LEU . 1.8 mp0 -64.74 -53.54 45.53 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -42.02 -54.02 3.68 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.947 ' O ' HG22 ' A' ' 59' ' ' THR . 69.1 t -46.72 -58.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.126 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -48.86 -46.98 43.13 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.98 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.9 mp -62.27 -34.3 76.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.132 0.491 . . . . 0.0 111.413 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.049 HD21 ' HB2' ' A' ' 43' ' ' ALA . 18.9 mt -87.89 -14.1 40.26 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -177.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.947 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.4 t . . . . . 0 C--N 1.32 -0.701 0 C-N-CA 119.523 -0.871 . . . . 0.0 112.887 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.279 0 CA-C-O 120.385 0.136 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.038 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.77 -20.56 30.83 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.845 179.027 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.891 ' N ' HD22 ' A' ' 102' ' ' LEU . 3.2 mt-30 -68.34 -35.63 78.05 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -81.06 -49.66 10.61 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.352 -1.295 . . . . 0.0 110.61 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.92 -42.27 97.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.674 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.0 mm -65.07 -50.04 76.45 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.792 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.08 -47.92 84.1 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.9 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.43 -43.69 88.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.771 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -18.94 38.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.175 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 2.4 tt . . . . . 0 C--N 1.32 -0.692 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.424 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' GLU . 12.3 mm-40 . . . . . 0 C--O 1.232 0.182 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.852 HD23 HD23 ' A' ' 40' ' ' LEU . 15.9 tp -45.42 -49.84 12.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.411 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 1.1 tmt_? -63.27 -20.57 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.161 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 27' ' ' GLN . 4.8 tp10 -84.39 -22.07 30.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.127 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.516 HD12 ' HA ' ' A' ' 28' ' ' LEU . 13.7 mt -92.5 -52.98 9.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.727 0.775 . . . . 0.0 110.72 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.444 ' OG1' HG13 ' A' ' 34' ' ' ILE . 9.7 p -81.76 -36.8 28.12 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.378 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 29' ' ' ARG . . . 79.14 35.78 29.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.703 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -98.57 140.66 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.989 0.423 . . . . 0.0 111.201 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -112.06 22.64 14.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.318 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.703 ' H ' HG22 ' A' ' 34' ' ' ILE . 4.4 t70 -110.67 74.44 0.92 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.979 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -35.88 -25.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.723 2.282 . . . . 0.0 112.393 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -68.9 -53.11 22.94 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 1.056 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -73.17 -24.97 60.62 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.154 0.502 . . . . 0.0 109.652 -179.794 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.852 HD23 HD23 ' A' ' 28' ' ' LEU . 0.6 OUTLIER -69.67 -51.43 34.74 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.625 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -24.97 63.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.94 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -68.31 -39.16 82.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.955 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -68.93 -55.68 10.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.446 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.84 ' CD1' HD22 ' A' ' 28' ' ' LEU . 7.5 mp -53.86 -36.75 62.95 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.25 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -53.99 37.15 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.56 -24.89 50.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.74 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.58 -7.65 49.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 65.88 39.01 4.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.811 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.53 -23.39 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.517 ' C ' ' OD1' ' A' ' 50' ' ' ASP . 16.4 t0 -64.17 93.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.651 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.5 tt -50.59 -57.87 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.143 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.651 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 38.6 m -42.07 -53.46 3.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.98 0.419 . . . . 0.0 110.28 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.656 ' O ' HD12 ' A' ' 57' ' ' LEU . 2.2 mt-30 -57.04 -53.89 52.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.209 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.538 ' HB1' HD12 ' A' ' 44' ' ' LEU . . . -40.38 -57.3 1.81 Allowed 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.615 HG22 HD12 ' A' ' 28' ' ' LEU . 40.3 t -46.62 -60.75 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.856 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -42.39 -49.71 5.17 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.741 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.656 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.3 mp -60.43 -36.66 78.7 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.696 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.056 HD22 ' CE2' ' A' ' 39' ' ' PHE . 11.5 mt -90.84 -11.01 40.61 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.171 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.457 HG21 HG12 ' A' ' 55' ' ' VAL . 82.2 p . . . . . 0 C--N 1.317 -0.812 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.624 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 37.6 t70 . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.438 0.161 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.8 HD22 ' N ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -83.5 -24.83 31.55 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.069 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.8 ' N ' HD22 ' A' ' 102' ' ' LEU . 1.8 mt-30 -68.08 -39.89 82.82 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 118.992 -1.083 . . . . 0.0 109.3 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -51.57 9.03 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.744 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.14 78.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 5.4 mm -61.55 -57.98 9.62 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.788 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -51.85 -44.68 63.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 110.921 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.5 tp -59.3 -40.96 87.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.715 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.04 -17.13 36.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.413 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.958 ' O ' HD12 ' A' ' 110' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.687 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.804 0.335 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.902 HD22 ' CD2' ' A' ' 44' ' ' LEU . 40.8 tp -47.77 -55.99 8.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.696 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -62.1 -25.99 68.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.897 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 29' ' ' ARG . 10.4 mt-10 -76.54 -27.29 55.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.026 0.441 . . . . 0.0 110.375 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.607 HG21 HG11 ' A' ' 55' ' ' VAL . 54.4 mt -85.1 -43.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.787 0.803 . . . . 0.0 110.618 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 28' ' ' LEU . 7.7 p -90.6 -34.73 15.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.469 -178.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 81.71 35.36 22.5 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.761 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -94.95 148.47 5.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.895 0.379 . . . . 0.0 111.007 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -117.83 23.25 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.212 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.761 ' H ' HG22 ' A' ' 34' ' ' ILE . 17.2 m-20 -119.45 72.83 14.74 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.637 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.533 ' HA ' HD12 ' A' ' 40' ' ' LEU . 67.8 Cg_exo -36.37 -20.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.79 2.326 . . . . 0.0 112.036 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -72.51 -53.76 11.15 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.728 -1.123 . . . . 0.0 111.387 -179.245 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.825 ' CZ ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.13 -28.41 64.27 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.609 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 8.5 mt -62.35 -51.97 65.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 -59.69 -33.98 72.27 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.721 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -56.32 -47.76 78.08 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.006 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -63.83 -54.24 38.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.732 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.902 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.3 mm? -46.89 -37.36 8.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.866 0.365 . . . . 0.0 110.325 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -80.79 -28.53 36.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.323 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.466 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -77.31 -21.62 53.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.118 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.504 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 59.7 p -101.02 17.78 21.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.77 0.319 . . . . 0.0 110.987 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.504 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.1 OUTLIER 48.89 32.16 3.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.151 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.08 -24.29 31.69 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.522 ' OD2' ' NE2' ' A' ' 53' ' ' GLN . 25.4 m-20 -65.57 99.7 0.45 Allowed 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.386 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.1 tt -57.58 -56.73 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.864 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.662 ' N ' HG23 ' A' ' 51' ' ' ILE . 55.4 m -43.55 -60.13 1.88 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.021 0.438 . . . . 0.0 110.071 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.563 ' O ' HD12 ' A' ' 57' ' ' LEU . 27.2 mt-30 -50.13 -57.98 6.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.635 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.642 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -38.48 -58.39 1.03 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.978 ' O ' HG22 ' A' ' 59' ' ' THR . 11.0 t -42.69 -57.46 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.091 0 CA-C-N 115.29 -0.868 . . . . 0.0 108.722 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.456 ' N ' ' O ' ' A' ' 53' ' ' GLN . 6.8 t -48.47 -47.32 38.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.359 -1.291 . . . . 0.0 110.919 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.563 HD12 ' O ' ' A' ' 53' ' ' GLN . 4.2 mp -59.65 -36.34 76.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.092 0.472 . . . . 0.0 110.988 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.006 HD21 ' HB2' ' A' ' 43' ' ' ALA . 27.5 mt -81.18 -22.65 38.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.797 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.978 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.644 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.19 -178.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.172 0 CA-C-O 120.789 0.328 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.877 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.6 pp -79.47 -34.65 41.28 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.212 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.877 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -62.57 -40.37 96.64 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.813 0.816 . . . . 0.0 109.392 -179.073 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.2 -56.55 4.27 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.889 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.21 -44.67 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.17 0.509 . . . . 0.0 109.834 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.652 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.9 mm -64.63 -53.15 45.83 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.388 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.91 -50.15 73.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.94 0.4 . . . . 0.0 110.605 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.405 ' HA ' HD13 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -55.89 -46.3 78.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.852 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.54 -16.93 53.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.995 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.321 -0.668 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.556 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.766 ' O ' HG22 ' A' ' 31' ' ' ILE . 3.9 mm-40 . . . . . 0 C--O 1.226 -0.155 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.84 HD23 ' H ' ' A' ' 29' ' ' ARG . 1.4 pt? -70.68 -48.6 53.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.519 -178.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.84 ' H ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.5 -26.6 67.24 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.526 -179.224 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -87.87 -57.5 2.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.22 0.533 . . . . 0.0 110.47 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.766 HG22 ' O ' ' A' ' 27' ' ' GLN . 16.4 tt -54.43 -35.46 31.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.672 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.523 HG23 HG23 ' A' ' 31' ' ' ILE . 46.8 p -92.25 -31.28 15.47 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.722 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 70.25 36.31 70.68 Favored Glycine 0 N--CA 1.462 0.394 0 N-CA-C 109.103 -1.599 . . . . 0.0 109.103 -179.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.998 HG22 ' H ' ' A' ' 36' ' ' ASP . 3.8 mm -92.5 152.92 3.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.583 -0.808 . . . . 0.0 112.633 -177.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -122.93 18.75 10.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.483 178.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.998 ' H ' HG22 ' A' ' 34' ' ' ILE . 1.4 m-20 -119.54 65.56 8.92 Favored Pre-proline 0 N--CA 1.455 -0.19 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.61 ' HA ' HD12 ' A' ' 40' ' ' LEU . 70.6 Cg_exo -35.81 -20.33 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.851 0 C-N-CA 122.973 2.448 . . . . 0.0 111.971 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 36' ' ' ASP . 25.2 t -75.33 -52.68 10.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.787 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.727 ' CE1' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.1 -24.15 62.24 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.617 HD22 ' HG ' ' A' ' 28' ' ' LEU . 24.0 mt -66.41 -59.9 3.25 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.337 -1.302 . . . . 0.0 108.917 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.653 ' C ' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -53.89 -40.31 66.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.603 179.51 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -49.88 -48.73 51.23 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.929 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -61.67 -59.94 4.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.498 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.465 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 2.2 mm? -45.27 -24.24 0.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.887 0.375 . . . . 0.0 110.017 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HD3' ' ND1' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -82.64 -42.24 18.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.792 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.6 -24.29 53.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.474 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 84.1 p -84.92 -2.95 58.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.344 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.7 m120 60.73 26.84 16.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.101 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.97 -24.03 31.85 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 121.027 -0.606 . . . . 0.0 111.75 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.16 102.62 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.697 -0.401 . . . . 0.0 109.947 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.685 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.8 OUTLIER -58.77 -57.41 11.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.873 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.647 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 25.8 m -41.2 -61.28 1.04 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.197 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.609 ' O ' HD12 ' A' ' 57' ' ' LEU . 31.9 mt-30 -50.58 -55.99 13.78 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.618 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.21 -54.03 3.02 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.951 ' O ' HG22 ' A' ' 59' ' ' THR . 23.4 t -45.57 -59.51 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.221 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.1 t -45.38 -49.24 13.24 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.101 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.609 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.5 mp -63.54 -27.62 69.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.811 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.929 HD21 ' HB2' ' A' ' 43' ' ' ALA . 89.4 mt -91.49 -9.48 44.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.704 -178.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--N 1.323 -0.547 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.41 -179.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.9 t0 . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.724 0.297 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.063 HD12 ' N ' ' A' ' 103' ' ' GLN . 3.9 pp -78.85 -32.71 46.16 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.085 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 1.063 ' N ' HD12 ' A' ' 102' ' ' LEU . 2.1 tt0 -65.3 -38.86 91.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.761 0.791 . . . . 0.0 109.733 -178.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.79 -49.92 12.19 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.93 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.435 0.636 . . . . 0.0 109.399 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.666 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -63.46 -43.43 98.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.975 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.83 80.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.186 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.92 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.58 -20.71 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.183 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.573 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.321 -0.664 0 CA-C-O 121.57 0.7 . . . . 0.0 109.143 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 . . . . . 0 C--O 1.234 0.256 0 CA-C-O 121.186 0.517 . . . . 0.0 109.607 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.796 HD13 ' HB3' ' A' ' 40' ' ' LEU . 5.1 mt -44.76 -59.32 2.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.362 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -69.32 -20.49 63.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.095 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.97 -21.36 40.39 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.788 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.498 HG21 HG11 ' A' ' 55' ' ' VAL . 30.8 mt -98.5 -50.76 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.387 0.613 . . . . 0.0 111.491 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.461 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -85.6 -37.21 19.8 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.492 -178.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.95 36.11 37.1 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.85 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -97.15 154.8 3.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.973 0.416 . . . . 0.0 111.203 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -121.65 23.5 10.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.044 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.85 ' H ' HG22 ' A' ' 34' ' ' ILE . 2.4 t70 -121.98 73.73 36.36 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.366 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.574 ' HA ' HD12 ' A' ' 40' ' ' LEU . 56.2 Cg_exo -36.99 -21.14 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.954 2.436 . . . . 0.0 112.37 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 36' ' ' ASP . 9.3 m -68.57 -54.27 17.68 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.841 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.853 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -75.5 -26.57 58.25 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.796 ' HB3' HD13 ' A' ' 28' ' ' LEU . 10.6 mt -61.31 -60.29 3.97 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.475 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -52.6 -50.75 62.43 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.754 179.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 41' ' ' HIS . 25.1 tt0 -40.33 -47.28 2.49 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -60.4 -49.63 76.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.066 178.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.769 ' CD2' HD11 ' A' ' 28' ' ' LEU . 1.0 OUTLIER -58.01 -25.22 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.437 179.671 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 41' ' ' HIS . 11.3 mmmt -79.07 -38.98 35.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.94 0.4 . . . . 0.0 110.433 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.6 -26.62 41.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.106 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.487 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 1.9 p -88.32 10.36 20.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.262 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.0 OUTLIER 49.88 30.78 4.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.723 0.297 . . . . 0.0 110.888 179.624 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.51 -23.42 35.15 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.437 ' O ' ' OG ' ' A' ' 47' ' ' SER . 29.6 t0 -63.03 96.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.029 0.442 . . . . 0.0 110.172 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.62 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.0 OUTLIER -56.35 -52.73 48.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.572 -178.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.62 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.4 m -50.82 -46.11 59.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.052 0.453 . . . . 0.0 110.929 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.605 ' O ' HD12 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -65.86 -53.56 38.2 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.653 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.45 -54.56 3.07 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.824 ' O ' HG22 ' A' ' 59' ' ' THR . 42.6 t -46.62 -57.17 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.757 177.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -49.39 -45.97 46.73 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.993 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.9 mp -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.853 HD22 ' CE2' ' A' ' 39' ' ' PHE . 79.8 mt -86.16 -23.95 26.36 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.899 -178.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.824 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.312 -1.048 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.104 -178.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.1 t70 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.792 0.33 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.02 HD12 ' N ' ' A' ' 103' ' ' GLN . 3.6 pp -76.74 -31.12 56.91 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.61 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 1.02 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -64.1 -39.72 94.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.783 0.801 . . . . 0.0 109.486 -178.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.55 -56.39 4.75 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.209 -1.36 . . . . 0.0 110.438 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.47 39.14 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.661 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -50.46 -65.84 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.317 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.02 15.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.55 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.23 -28.68 69.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.666 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.59 -16.65 18.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.043 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.678 HD13 ' O ' ' A' ' 110' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.32 -0.705 0 CA-C-O 121.552 0.691 . . . . 0.0 109.659 -179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' GLU . 24.3 mm-40 . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.98 0.419 . . . . 0.0 109.996 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.918 HD22 ' CD2' ' A' ' 44' ' ' LEU . 10.3 tp -46.6 -51.66 15.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.8 179.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttt180 -63.78 -21.4 66.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.8 tt0 -84.63 -21.91 30.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.579 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.539 HG21 HG11 ' A' ' 55' ' ' VAL . 44.3 mt -94.35 -50.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.493 0.663 . . . . 0.0 111.311 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.517 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.5 p -85.52 -37.83 19.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.397 -178.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.36 36.32 17.67 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.654 HG21 ' CD1' ' A' ' 39' ' ' PHE . 1.1 mm -97.57 143.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.736 0.303 . . . . 0.0 110.351 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -114.89 23.38 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.863 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.645 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -113.83 73.19 2.21 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.338 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -35.11 -24.21 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.938 2.425 . . . . 0.0 112.503 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.2 OUTLIER -71.4 -52.31 19.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.797 179.783 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 1.107 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.19 -28.38 64.18 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.772 HD23 HD23 ' A' ' 28' ' ' LEU . 1.2 mp -70.3 -48.35 57.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -62.18 -27.25 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.228 178.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -65.19 -48.38 73.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.885 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -62.2 -47.46 84.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.918 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -55.64 -42.58 75.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.189 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.453 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 5.0 tmtt? -74.44 -27.19 60.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.763 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.453 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -79.2 -24.15 43.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.084 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 0.4 OUTLIER -96.2 17.01 16.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.162 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 61.95 22.13 12.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.195 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.78 -23.53 33.55 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -62.96 124.03 20.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.738 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.1 tt -74.72 -55.49 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.077 -179.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.632 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.0 m -43.46 -54.19 4.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 0.0 110.169 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.589 ' O ' HD12 ' A' ' 57' ' ' LEU . 25.6 mt-30 -57.73 -54.52 45.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.469 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -40.37 -51.18 2.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.738 HG23 ' O ' ' A' ' 51' ' ' ILE . 18.1 t -50.38 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.024 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.0 t -41.94 -48.31 4.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.286 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.589 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.6 mp -63.09 -29.82 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.934 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.107 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 37.7 mt -89.93 -11.19 42.46 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -177.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.717 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--N 1.324 -0.536 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.832 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.239 0.543 0 CA-C-O 120.753 0.311 . . . . 0.0 111.785 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 1.044 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.19 -17.24 46.88 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.717 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.886 ' N ' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -71.46 -37.16 71.38 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.84 -49.49 20.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.159 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.46 76.45 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.713 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.5 mm -53.96 -48.17 63.86 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.986 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.12 -34.49 73.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.049 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 tp -69.64 -22.7 63.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -107.11 -18.93 13.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 28.5 tp . . . . . 0 C--N 1.319 -0.736 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.206 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.679 ' OE1' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.786 0.327 . . . . 0.0 110.494 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.719 HD22 HD21 ' A' ' 44' ' ' LEU . 1.1 mt -51.84 -51.65 55.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.013 0.435 . . . . 0.0 111.072 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -22.56 46.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.552 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.35 -32.07 22.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.463 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.587 HG21 HG11 ' A' ' 55' ' ' VAL . 62.8 mt -78.9 -55.86 8.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.536 0.684 . . . . 0.0 110.943 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.529 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -78.09 -37.32 46.7 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.762 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.9 36.75 12.68 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -179.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.846 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -98.1 149.43 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.957 0.408 . . . . 0.0 110.851 -179.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -119.56 23.37 11.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.155 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.846 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -120.03 69.04 13.47 Favored Pre-proline 0 N--CA 1.453 -0.325 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.982 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -35.51 -20.45 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.864 2.376 . . . . 0.0 112.044 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.671 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.1 OUTLIER -74.76 -53.26 9.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.438 -179.328 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 1.081 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.78 -24.39 63.5 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.72 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.511 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 2.2 mt -67.47 -59.42 3.39 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.749 ' CE1' ' NZ ' ' A' ' 45' ' ' LYS . 1.2 t-80 -53.91 -26.39 24.87 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.814 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -64.95 -47.55 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 1.002 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -64.57 -46.39 82.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.66 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.719 HD21 HD22 ' A' ' 28' ' ' LEU . 4.6 mm? -56.14 -36.86 68.73 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.749 ' NZ ' ' CE1' ' A' ' 41' ' ' HIS . 25.9 mttp -68.93 -46.66 67.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.734 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.6 -22.12 64.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.918 0.39 . . . . 0.0 110.708 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.523 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 62.4 p -90.57 17.6 7.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.489 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.531 ' ND2' ' OD2' ' A' ' 50' ' ' ASP . 0.6 OUTLIER 48.57 30.27 2.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.0 -23.5 35.44 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.531 ' OD2' ' ND2' ' A' ' 48' ' ' ASN . 89.9 m-20 -58.26 115.44 2.95 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.138 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.706 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -69.27 -58.36 5.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.898 -179.255 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.601 ' N ' HG22 ' A' ' 51' ' ' ILE . 22.5 m -45.51 -57.15 4.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.012 0.434 . . . . 0.0 110.575 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.676 ' O ' HD12 ' A' ' 57' ' ' LEU . 8.9 mm100 -51.51 -59.09 4.64 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.609 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.547 ' HA ' HD13 ' A' ' 57' ' ' LEU . . . -39.03 -54.76 1.66 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.478 0.656 . . . . 0.0 109.338 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.722 ' O ' HG22 ' A' ' 59' ' ' THR . 41.2 t -45.18 -59.19 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.48 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 53' ' ' GLN . 5.0 t -43.93 -49.69 8.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.642 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.2 mp -60.23 -30.31 69.32 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.249 0.547 . . . . 0.0 110.439 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 1.081 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 41.4 mt -88.07 -14.53 38.66 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.082 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.545 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.351 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.8 0.333 . . . . 0.0 110.107 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.846 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.21 -23.48 30.47 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.871 179.267 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.577 ' N ' HD22 ' A' ' 102' ' ' LEU . 1.1 mt-30 -67.94 -38.4 82.78 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 118.985 -1.086 . . . . 0.0 108.953 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.74 -51.98 9.03 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.689 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.62 -44.44 85.52 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.425 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -64.47 -43.87 96.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.038 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.27 -53.14 53.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.978 0.418 . . . . 0.0 110.793 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.74 HD23 ' O ' ' A' ' 108' ' ' LEU . 2.7 tt -54.77 -43.54 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.751 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.61 -19.85 32.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.47 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.584 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 3.7 tt . . . . . 0 C--N 1.321 -0.657 0 CA-C-O 121.103 0.478 . . . . 0.0 109.787 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.1 ptt? . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.812 HG23 ' N ' ' A' ' 3' ' ' ALA . 12.6 t -118.04 -138.83 0.36 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.586 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.812 ' N ' HG23 ' A' ' 2' ' ' THR . . . -93.17 176.15 6.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.545 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.747 ' C ' HD13 ' A' ' 5' ' ' LEU . 7.7 pt-20 -101.38 154.58 18.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.588 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.985 ' N ' HD13 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -134.8 175.16 9.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.561 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.522 ' O ' ' O ' ' A' ' 5' ' ' LEU . 5.4 tp60 39.84 98.68 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.468 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -80.27 -4.98 55.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.661 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.35 -19.43 39.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.142 0.496 . . . . 0.0 110.216 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.413 ' O ' ' O ' ' A' ' 10' ' ' ALA . 22.8 m-20 -63.27 -20.09 65.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.224 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.413 ' O ' ' O ' ' A' ' 9' ' ' ASP . . . 42.96 -167.9 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.75 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -132.05 -42.48 0.99 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.513 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -158.83 -172.79 26.39 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.43 163.39 1.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.719 0.295 . . . . 0.0 110.613 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -157.45 59.54 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.577 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -124.54 -167.03 1.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.561 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.91 25.36 4.84 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.648 ' ND1' ' N ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -93.55 -22.16 18.99 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.626 179.905 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.648 ' N ' ' ND1' ' A' ' 17' ' ' HIS . . . 21.73 81.09 0.01 OUTLIER Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.525 ' C ' ' O ' ' A' ' 18' ' ' GLY . 0.1 OUTLIER 28.84 85.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 110.669 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.576 ' OG ' ' O ' ' A' ' 17' ' ' HIS . 2.5 p 171.62 69.16 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.639 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -77.23 172.9 12.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.495 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.464 ' O ' ' CB ' ' A' ' 26' ' ' ASN . 1.9 pt20 -81.15 -12.43 59.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 3.6 ptt? -67.15 -31.15 71.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.949 0.404 . . . . 0.0 111.211 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.432 ' HB2' HD23 ' A' ' 25' ' ' LEU . 19.0 mt -61.93 -63.95 1.09 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.083 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.799 HD23 ' H ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -70.53 -32.95 70.6 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.12 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.584 ' C ' HD22 ' A' ' 26' ' ' ASN . 0.6 OUTLIER -59.26 -59.87 4.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.656 0.741 . . . . 0.0 109.684 179.765 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HB2' HD11 ' A' ' 51' ' ' ILE . 1.7 mm100 -54.48 -53.37 55.14 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.981 -1.009 . . . . 0.0 108.985 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.501 HD23 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -45.62 -51.62 11.86 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.065 178.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 29' ' ' ARG . 1.7 mtp180 -64.06 -22.23 66.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.617 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.535 ' OE2' ' ND2' ' A' ' 26' ' ' ASN . 45.0 mt-10 -85.46 -20.2 30.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.847 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.7 HD13 HG21 ' A' ' 55' ' ' VAL . 16.6 mt -93.83 -50.84 11.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.575 0.702 . . . . 0.0 111.396 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.531 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 1.6 p -92.69 -38.0 12.08 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.143 -177.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.42 35.97 35.58 Favored Glycine 0 CA--C 1.522 0.5 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.697 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -90.81 150.5 3.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.054 0.454 . . . . 0.0 111.057 -179.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.423 ' H ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -114.38 23.74 12.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.988 -179.113 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.697 ' H ' HG22 ' A' ' 34' ' ' ILE . 40.1 t0 -120.64 74.37 24.61 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.156 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -36.07 -25.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.929 2.419 . . . . 0.0 112.177 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.557 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -73.13 -51.62 17.28 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.09 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.925 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.31 -27.44 64.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -69.45 -55.94 8.84 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.311 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -58.14 -25.17 61.12 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.386 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -66.29 -49.1 68.23 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.915 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -58.14 -44.85 88.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.248 179.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.501 HD21 HD23 ' A' ' 28' ' ' LEU . 3.7 mm? -63.05 -34.0 76.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.011 0.434 . . . . 0.0 110.097 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 1.4 tmtm? -72.9 -30.8 64.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.033 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.454 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.42 -28.79 28.61 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.245 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.709 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 1.1 m -84.5 3.59 35.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.423 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m120 68.54 21.31 8.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.166 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.66 0.35 49.43 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.479 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.28 130.57 34.55 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.139 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.562 HG22 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -78.01 -52.2 16.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.512 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.562 ' N ' HG22 ' A' ' 51' ' ' ILE . 28.5 m -52.26 -53.2 46.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.886 0.374 . . . . 0.0 111.268 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.487 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 81.9 mm-40 -59.39 -56.77 17.84 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.427 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.709 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -41.69 -57.31 2.34 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-O 122.193 0.997 . . . . 0.0 108.593 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.7 HG21 HD13 ' A' ' 31' ' ' ILE . 2.1 t -43.02 -57.99 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 113.454 -1.703 . . . . 0.0 108.324 177.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.453 ' N ' HG12 ' A' ' 55' ' ' VAL . 2.7 t -46.73 -52.94 12.85 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.164 178.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 13.7 mt -50.18 -38.97 42.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.219 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.925 HD22 ' CE2' ' A' ' 39' ' ' PHE . 21.0 mt -81.03 -53.81 6.1 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.407 -0.815 . . . . 0.0 113.123 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.675 HG23 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -56.81 -22.15 34.19 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.557 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 3.0 t70 -97.88 67.22 1.95 Allowed 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.081 178.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.557 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 4.2 tt0 84.25 89.09 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -178.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.453 ' HG3' ' H ' ' A' ' 63' ' ' VAL . 0.9 OUTLIER -107.34 -73.8 0.68 Allowed 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.336 0.589 . . . . 0.0 111.163 -178.59 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.453 ' H ' ' HG3' ' A' ' 62' ' ' ARG . 22.7 t -102.36 -104.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.902 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt 61.22 -122.44 0.84 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.391 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.503 ' CA ' ' OE1' ' A' ' 65' ' ' GLU . 0.2 OUTLIER 174.68 81.67 0.07 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.957 0.408 . . . . 0.0 110.875 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.604 ' O ' ' C ' ' A' ' 67' ' ' SER . 71.8 Cg_endo -81.95 -102.54 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 122.883 2.389 . . . . 0.0 111.761 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.604 ' C ' ' O ' ' A' ' 66' ' ' PRO . 22.1 m 6.88 -85.94 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.324 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.586 ' O ' ' O ' ' A' ' 67' ' ' SER . 15.2 mt-30 -44.95 -176.19 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.38 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.615 ' O ' ' O ' ' A' ' 70' ' ' THR . 3.0 m-20 -89.31 -53.57 4.5 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.261 0.553 . . . . 0.0 110.768 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.615 ' O ' ' O ' ' A' ' 69' ' ' ASP . 72.4 p 30.73 -158.91 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.675 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.969 HG12 ' H ' ' A' ' 72' ' ' ALA . 2.5 t 28.86 -153.45 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.698 0.761 . . . . 0.0 111.067 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.969 ' H ' HG12 ' A' ' 71' ' ' VAL . . . -114.41 -28.36 7.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.212 178.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 72' ' ' ALA . 0.2 OUTLIER -49.78 -170.19 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.108 -1.406 . . . . 0.0 110.869 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.416 ' H ' HG22 ' A' ' 73' ' ' THR . 4.4 pt-20 -104.82 149.03 37.05 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.166 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.13 154.78 57.23 Favored 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.623 2.215 . . . . 0.0 112.117 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.0 m -137.42 85.08 2.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.541 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -107.52 -4.42 18.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.485 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.57 ' O ' ' O ' ' A' ' 79' ' ' GLU . 2.9 t -130.67 -126.45 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.642 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.57 ' O ' ' O ' ' A' ' 78' ' ' VAL . 11.7 mt-10 -26.37 147.79 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.901 0.381 . . . . 0.0 110.66 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 168.23 -3.59 0.04 OUTLIER Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.548 ' O ' ' O ' ' A' ' 82' ' ' ALA . 0.7 OUTLIER -94.57 -169.05 1.95 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.742 0.306 . . . . 0.0 110.584 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.548 ' O ' ' O ' ' A' ' 81' ' ' SER . . . -40.59 172.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.872 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -177.82 -144.83 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.437 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.42 ' N ' HD22 ' A' ' 84' ' ' ASN . 1.6 m-80 -66.07 -4.03 6.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.401 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.681 ' O ' ' N ' ' A' ' 87' ' ' VAL . 15.3 tttp -70.79 -80.15 0.06 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.614 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.605 ' O ' HG23 ' A' ' 87' ' ' VAL . 0.8 OUTLIER -31.88 -27.73 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.63 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.681 ' N ' ' O ' ' A' ' 85' ' ' LYS . 77.3 t -161.84 128.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.685 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.416 ' O ' ' O ' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -90.55 -29.5 17.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.525 0.678 . . . . 0.0 109.536 179.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.416 ' O ' ' O ' ' A' ' 88' ' ' LEU . . . 44.9 -172.16 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.728 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.13 -156.61 0.57 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.43 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.48 ' O ' HG12 ' A' ' 91' ' ' VAL . 4.1 t 65.73 23.31 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.74 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.417 ' C ' ' O ' ' A' ' 91' ' ' VAL . 3.9 pt -39.02 131.71 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.494 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -168.64 112.63 0.58 Allowed 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.28 0.562 . . . . 0.0 110.195 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.66 ' O ' ' ND2' ' A' ' 98' ' ' ASN . 0.2 OUTLIER -131.53 -52.29 1.0 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.832 -179.059 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.485 ' H ' ' HG ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -76.38 -162.56 0.25 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.24 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.529 ' CG ' ' H ' ' A' ' 97' ' ' ASP . 31.1 t-80 53.88 -125.92 2.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.331 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.529 ' H ' ' CG ' ' A' ' 96' ' ' HIS . 21.3 p-10 -97.05 96.44 8.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.222 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.695 ' O ' ' N ' ' A' ' 100' ' ' ASP . 0.2 OUTLIER -109.32 150.45 27.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.887 -179.623 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.437 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER 40.19 11.22 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.23 179.699 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.695 ' N ' ' O ' ' A' ' 98' ' ' ASN . 3.4 t0 -44.64 -20.36 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.75 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.437 ' N ' ' O ' ' A' ' 99' ' ' LYS . 0.7 OUTLIER -58.71 -60.24 4.13 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.879 -179.552 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.697 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.1 pp -82.11 -30.31 31.27 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.697 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -68.14 -34.14 75.79 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.6 0.714 . . . . 0.0 109.881 -178.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.549 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -80.94 -48.48 12.24 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.232 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.78 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.693 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -65.63 -42.72 93.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.838 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.12 -48.2 68.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.966 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -38.56 83.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.66 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -20.7 25.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.86 0.362 . . . . 0.0 111.461 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.557 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 23.1 tp -82.31 -26.07 33.37 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.537 0.684 . . . . 0.0 109.459 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 111' ' ' LEU . 1.0 OUTLIER -75.51 -17.9 59.97 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.074 -179.75 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -106.0 -21.08 13.23 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.989 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.563 ' O ' ' O ' ' A' ' 114' ' ' PRO . 0.1 OUTLIER -106.69 171.2 4.93 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.8 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.563 ' O ' ' O ' ' A' ' 113' ' ' SER . 50.1 Cg_exo -49.11 -128.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.964 2.442 . . . . 0.0 112.34 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -121.28 -93.64 0.52 Allowed 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.269 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.64 145.34 13.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.584 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -130.75 -2.4 4.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.638 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 41.69 -138.58 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.533 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -73.78 -42.39 61.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.619 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.714 0 CA-C-O 118.026 -1.43 . . . . 0.0 110.875 -179.994 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.513 ' O ' ' C ' ' A' ' 2' ' ' THR . 8.8 tpt . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.513 ' C ' ' O ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -29.29 129.86 0.08 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.493 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.6 -107.43 0.34 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.731 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 56.7 tt0 -109.56 -32.25 7.19 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.968 0.413 . . . . 0.0 110.977 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.02 ' H ' HD13 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -68.31 157.26 36.01 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.528 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.518 ' NE2' ' OD1' ' A' ' 9' ' ' ASP . 6.1 tt0 179.85 154.7 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.471 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.42 -15.66 14.96 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.922 0.392 . . . . 0.0 110.635 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.442 ' H ' ' HG2' ' A' ' 6' ' ' GLN . 12.6 t0 -84.36 -63.17 1.39 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.301 0.572 . . . . 0.0 110.332 179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.579 ' O ' ' O ' ' A' ' 10' ' ' ALA . 2.4 m-20 -62.32 -21.84 65.59 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.228 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.579 ' O ' ' O ' ' A' ' 9' ' ' ASP . . . -39.36 172.01 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.672 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -119.04 118.2 30.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.701 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.484 ' O ' ' C ' ' A' ' 13' ' ' ALA . . . -120.83 78.65 0.32 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.484 ' C ' ' O ' ' A' ' 12' ' ' GLY . . . 33.14 -120.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.819 0.342 . . . . 0.0 110.478 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -115.73 64.01 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.375 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.569 ' CG ' ' H ' ' A' ' 16' ' ' GLY . 38.6 t0 66.94 -144.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.503 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.569 ' H ' ' CG ' ' A' ' 15' ' ' ASP . . . -157.89 -177.06 30.64 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -95.73 -80.21 0.43 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.778 0.323 . . . . 0.0 110.574 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.47 -5.76 3.23 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.961 -0.856 . . . . 0.0 110.961 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.1 m -133.54 -150.78 0.42 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.806 0.336 . . . . 0.0 110.403 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.5 p -143.34 94.22 2.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.337 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.637 ' O ' ' N ' ' A' ' 23' ' ' MET . 3.5 m -128.59 -161.62 1.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.882 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.502 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.8 pm0 -42.76 -12.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.667 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.637 ' N ' ' O ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -56.62 -57.89 10.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.179 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.639 ' O ' ' CD2' ' A' ' 28' ' ' LEU . 10.4 mt -52.28 -63.17 1.23 Allowed 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.411 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.089 HD22 ' H ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -51.23 -53.28 36.7 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.926 -179.203 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -56.16 -47.53 78.06 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.559 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.406 ' HB3' HD13 ' A' ' 51' ' ' ILE . 0.5 OUTLIER -56.91 -63.55 1.17 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.763 -178.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.838 HD22 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -53.26 -51.65 61.57 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.302 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -23.01 63.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.631 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.29 -44.12 16.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.546 HG21 HG11 ' A' ' 55' ' ' VAL . 63.1 mt -69.81 -54.78 17.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.416 0.627 . . . . 0.0 111.438 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.511 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 4.7 p -76.13 -36.59 58.75 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.553 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.2 36.15 60.24 Favored Glycine 0 CA--C 1.52 0.354 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.957 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.7 mm -90.62 151.29 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.173 0.511 . . . . 0.0 111.703 -178.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -119.33 23.26 11.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.707 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.957 ' H ' HG22 ' A' ' 34' ' ' ILE . 46.5 t0 -120.37 69.92 15.85 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.212 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HA ' HD12 ' A' ' 40' ' ' LEU . 83.1 Cg_exo -36.94 -21.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.753 2.302 . . . . 0.0 111.707 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -75.41 -52.74 10.03 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.356 -179.545 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.762 ' CE1' HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.22 -26.23 64.71 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.587 HD22 HD12 ' A' ' 28' ' ' LEU . 14.1 mt -66.33 -55.93 13.6 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -50.85 -37.18 41.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.598 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -58.22 -45.37 87.81 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -58.26 -54.11 50.68 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.027 178.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.838 HD21 HD22 ' A' ' 28' ' ' LEU . 3.8 mm? -62.64 -20.22 64.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.278 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -79.01 -54.13 6.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.973 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.26 -29.48 69.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.873 0.368 . . . . 0.0 110.502 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 50' ' ' ASP . 4.0 p -76.15 -16.75 59.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m120 68.24 33.37 4.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.498 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.48 -20.97 42.63 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.911 -0.875 . . . . 0.0 110.911 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.478 ' O ' ' CB ' ' A' ' 47' ' ' SER . 36.0 m-20 -68.53 118.46 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.832 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.1 OUTLIER -74.18 -53.17 17.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.52 -179.726 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.611 ' N ' HG22 ' A' ' 51' ' ' ILE . 39.3 m -45.76 -55.52 6.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.344 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.35 -57.35 11.6 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.674 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.876 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.86 -47.65 4.26 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.539 0.685 . . . . 0.0 109.785 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.985 ' O ' HG22 ' A' ' 59' ' ' THR . 24.6 t -53.95 -59.75 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.817 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -54.59 -44.82 73.37 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.806 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 54' ' ' ALA . 10.3 mt -58.09 -36.23 72.56 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.485 0.66 . . . . 0.0 110.893 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.762 HD23 ' CE1' ' A' ' 39' ' ' PHE . 7.2 mp -84.35 -40.23 18.14 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.787 -1.097 . . . . 0.0 113.268 -177.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.985 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.5 t -97.09 8.72 43.91 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.84 -178.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.582 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 0.4 OUTLIER -57.5 17.31 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.965 -0.294 . . . . 0.0 110.812 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.734 ' H ' ' C ' ' A' ' 59' ' ' THR . 5.2 tt0 87.97 52.88 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.148 0 CA-C-O 120.799 0.333 . . . . 0.0 110.879 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.672 ' O ' ' N ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -124.44 -63.08 1.21 Allowed 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 121.126 0.488 . . . . 0.0 111.372 -179.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.451 ' H ' ' HG2' ' A' ' 62' ' ' ARG . 2.8 t -40.2 -13.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.129 -179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.672 ' N ' ' O ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -137.93 155.85 48.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.986 0.422 . . . . 0.0 110.577 179.502 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.609 ' O ' ' O ' ' A' ' 66' ' ' PRO . 53.8 mp0 -131.28 133.94 25.14 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.205 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.609 ' O ' ' O ' ' A' ' 65' ' ' GLU . 52.5 Cg_exo -46.95 -130.15 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.451 2.1 . . . . 0.0 112.643 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.479 ' O ' ' C ' ' A' ' 68' ' ' GLN . 11.0 p 42.97 32.52 0.42 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.361 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.736 HE21 ' H ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER -33.69 148.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.684 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.736 ' H ' HE21 ' A' ' 68' ' ' GLN . 5.9 m-20 -80.83 -29.28 35.95 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.499 0.666 . . . . 0.0 110.461 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.7 p -119.5 131.92 55.67 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.289 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.1 m -144.96 129.9 13.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.654 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.582 ' O ' ' OG1' ' A' ' 73' ' ' THR . . . -49.74 -36.34 25.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.235 0.54 . . . . 0.0 110.306 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.582 ' OG1' ' O ' ' A' ' 72' ' ' ALA . 84.9 m -176.52 -67.14 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.564 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.404 ' C ' ' O ' ' A' ' 73' ' ' THR . 0.9 OUTLIER -36.79 102.73 0.24 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.265 -179.731 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -82.5 163.74 16.74 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.653 2.235 . . . . 0.0 111.754 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.43 -157.74 0.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.904 0.383 . . . . 0.0 110.632 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.543 ' N ' ' CD ' ' A' ' 77' ' ' GLU . 22.0 mp0 -127.65 -101.37 0.35 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.757 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 1.032 HG22 ' H ' ' A' ' 79' ' ' GLU . 10.0 p -163.67 -146.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.346 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 1.032 ' H ' HG22 ' A' ' 78' ' ' VAL . 87.2 mt-10 -142.8 -76.23 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.769 0.318 . . . . 0.0 110.779 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -107.49 176.73 21.04 Favored Glycine 0 CA--C 1.525 0.714 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.4 m -111.76 -174.26 2.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.827 0.346 . . . . 0.0 110.671 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -49.16 168.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.856 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -126.99 -153.94 0.6 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.545 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -100.25 13.59 33.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.611 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.56 ' C ' ' H ' ' A' ' 87' ' ' VAL . 0.0 OUTLIER -111.09 -157.98 0.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.484 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 62.96 -8.93 0.12 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.042 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.56 ' H ' ' C ' ' A' ' 85' ' ' LYS . 97.8 t -143.03 132.78 21.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.925 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.662 HD23 ' O ' ' A' ' 88' ' ' LEU . 1.3 tt -90.92 -31.53 16.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.62 0.724 . . . . 0.0 109.63 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.509 ' O ' ' O ' ' A' ' 88' ' ' LEU . . . 50.28 165.56 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.131 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.566 ' HA ' ' HZ3' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -111.43 -144.46 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.045 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.633 ' O ' HG22 ' A' ' 91' ' ' VAL . 14.2 p -128.14 6.03 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.906 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.414 ' O ' ' O ' ' A' ' 91' ' ' VAL . 17.3 pt -41.38 162.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.384 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -178.75 113.62 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.971 0.415 . . . . 0.0 110.59 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.915 HD12 ' N ' ' A' ' 95' ' ' THR . 4.2 pp -117.62 -50.38 2.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.673 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.915 ' N ' HD12 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -52.12 -148.18 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.558 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.656 ' H ' HG22 ' A' ' 95' ' ' THR . 61.7 m-70 -162.13 179.9 7.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.343 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.555 ' O ' ' O ' ' A' ' 98' ' ' ASN . 4.4 p-10 31.76 39.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.038 0.447 . . . . 0.0 110.172 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.555 ' O ' ' O ' ' A' ' 97' ' ' ASP . 26.5 m120 -52.18 -122.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.925 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.444 ' CG ' ' H ' ' A' ' 100' ' ' ASP . 7.3 pttm -137.34 -110.93 0.18 Allowed 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.282 0.563 . . . . 0.0 111.947 -178.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.579 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -61.29 -25.27 66.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.577 -178.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.81 -60.9 2.89 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.091 -179.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.083 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.95 -19.71 36.65 Favored 'General case' 0 C--O 1.216 -0.666 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.442 -179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.908 ' N ' HD22 ' A' ' 102' ' ' LEU . 0.5 OUTLIER -67.77 -36.69 80.95 Favored 'General case' 0 CA--C 1.509 -0.611 0 C-N-CA 119.504 -0.879 . . . . 0.0 108.769 179.041 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.34 -52.36 8.21 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.516 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.57 -45.5 85.11 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.679 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.1 mm -62.73 -45.8 97.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.445 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.988 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.06 91.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.247 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.26 -40.53 94.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.843 0.354 . . . . 0.0 110.346 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.55 -18.02 32.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.902 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 1.001 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.2 tm? -93.73 -12.05 30.07 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.62 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.68 -21.11 66.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.452 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -68.37 -79.94 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.533 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.79 102.51 35.41 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.509 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -76.79 171.3 18.25 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 122.387 2.058 . . . . 0.0 111.92 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -159.74 -165.07 1.44 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.985 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.445 ' C ' ' H ' ' A' ' 118' ' ' ALA . 0.8 OUTLIER -134.52 -177.82 2.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.288 179.909 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.486 ' N ' ' CD ' ' A' ' 117' ' ' GLN . 3.7 mp0 -76.72 33.46 0.14 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.702 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.445 ' H ' ' C ' ' A' ' 116' ' ' ILE . . . 37.22 -138.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.659 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.536 ' C ' ' OD1' ' A' ' 119' ' ' ASP . 25.3 t0 -174.25 -74.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.571 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.696 0 CA-C-O 118.045 -1.42 . . . . 0.0 110.864 -179.973 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptm . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.1 m -67.32 -30.19 69.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.614 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 39.65 -139.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.623 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.06 -178.43 0.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.57 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.943 ' H ' HD22 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -85.16 158.33 20.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.563 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.487 ' C ' ' H ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER -78.28 -57.18 3.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.323 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 71.73 -14.85 0.48 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.487 ' H ' ' C ' ' A' ' 6' ' ' GLN . 0.8 OUTLIER -103.75 -19.56 14.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.385 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.598 ' O ' ' C ' ' A' ' 10' ' ' ALA . 1.6 m-20 -80.13 -41.03 26.2 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.472 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.598 ' C ' ' O ' ' A' ' 9' ' ' ASP . . . 13.9 -114.15 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.072 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.541 ' O ' ' C ' ' A' ' 12' ' ' GLY . . . -80.16 -113.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.171 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.541 ' C ' ' O ' ' A' ' 11' ' ' ALA . . . 26.66 56.77 0.09 OUTLIER Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' C ' ' A' ' 14' ' ' ALA . . . -143.65 -142.63 0.14 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 110.385 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' A' ' 13' ' ' ALA . . . -36.59 146.56 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.434 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -67.75 -138.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.588 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.78 179.15 21.38 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 62.4 m170 -107.27 -84.11 0.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.746 0.308 . . . . 0.0 110.359 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.57 ' O ' ' C ' ' A' ' 19' ' ' SER . . . 69.56 -151.18 50.48 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.294 -0.722 . . . . 0.0 111.294 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.57 ' C ' ' O ' ' A' ' 18' ' ' GLY . 0.7 OUTLIER -15.22 115.7 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.81 0.338 . . . . 0.0 111.396 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.58 93.43 2.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.545 ' H ' HD11 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -116.35 169.58 9.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.554 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -83.47 -19.03 36.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.048 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.3 ttm -60.34 -43.02 96.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.899 0.38 . . . . 0.0 111.82 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.564 ' HB3' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -54.17 -64.06 0.95 Allowed 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.2 -178.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -32.99 72.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.832 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -63.17 -59.09 5.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.149 0.499 . . . . 0.0 110.649 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -58.88 -61.29 2.74 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.489 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.637 ' HB3' HD23 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -45.49 -55.78 5.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.803 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 47.8 ttt-85 -67.31 -20.94 65.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.61 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -80.75 -24.14 38.9 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.449 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.576 HG21 HG11 ' A' ' 55' ' ' VAL . 46.2 mt -95.8 -54.83 6.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.571 0.7 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.441 ' OG1' HG13 ' A' ' 34' ' ' ILE . 5.8 p -78.88 -37.92 38.94 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.78 -178.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.79 36.04 30.02 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.746 HD12 ' CZ ' ' A' ' 39' ' ' PHE . 1.1 mm -98.74 144.78 11.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.789 0.328 . . . . 0.0 110.964 -179.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.522 ' OE1' ' N ' ' A' ' 35' ' ' GLN . 3.3 mp0 -113.35 22.7 13.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.658 ' H ' HG22 ' A' ' 34' ' ' ILE . 1.5 m-20 -111.46 71.6 0.89 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.354 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.442 ' O ' ' CG ' ' A' ' 41' ' ' HIS . 78.2 Cg_exo -35.31 -22.71 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.752 2.301 . . . . 0.0 111.92 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.638 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -74.06 -49.59 23.41 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.869 179.881 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.821 ' CE1' HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -73.92 -29.83 62.25 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.648 HD12 ' O ' ' A' ' 36' ' ' ASP . 1.7 mp -69.96 -49.81 48.03 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.462 -0.79 . . . . 0.0 108.87 177.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.442 ' CG ' ' O ' ' A' ' 37' ' ' PRO . 18.5 m170 -67.06 -24.02 65.93 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.464 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -68.17 -39.02 82.67 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.752 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -63.87 -50.12 70.06 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.963 178.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.597 HD21 HD12 ' A' ' 28' ' ' LEU . 81.7 mt -65.4 -24.38 67.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.942 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.8 -31.2 45.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.174 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.9 -35.6 26.01 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.928 0.394 . . . . 0.0 110.076 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.57 ' O ' ' OD1' ' A' ' 48' ' ' ASN . 72.3 p -84.28 12.55 6.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.705 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 47' ' ' SER . 24.0 p30 47.4 37.98 6.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.778 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.36 -24.0 32.42 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.244 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.09 104.46 1.16 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 117.267 0.534 . . . . 0.0 109.981 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.645 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.3 OUTLIER -60.77 -55.58 23.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.895 -179.183 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.645 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.9 m -40.88 -57.55 1.93 Allowed 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.322 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.404 ' O ' ' C ' ' A' ' 54' ' ' ALA . 8.6 mt-30 -51.18 -55.01 20.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.696 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.824 ' HA ' HD12 ' A' ' 57' ' ' LEU . . . -41.75 -44.63 3.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.46 0.648 . . . . 0.0 109.704 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.946 ' O ' HG22 ' A' ' 59' ' ' THR . 13.7 t -59.22 -59.6 3.61 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.75 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.567 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 22.3 t -52.95 -38.15 61.77 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.593 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 54' ' ' ALA . 8.7 mt -67.34 -40.56 85.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.264 0.554 . . . . 0.0 111.285 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.821 HD23 ' CE1' ' A' ' 39' ' ' PHE . 6.9 mp -80.37 -38.98 29.37 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.006 -0.997 . . . . 0.0 113.682 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.946 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.3 t -98.71 -10.94 22.46 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.756 -178.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.567 ' OD1' ' O ' ' A' ' 56' ' ' SER . 0.4 OUTLIER -34.82 -86.67 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.208 0.527 . . . . 0.0 109.85 179.445 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.557 ' H ' ' HD2' ' A' ' 62' ' ' ARG . 1.7 tt0 -152.87 61.44 0.79 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.948 179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.697 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -129.56 -93.5 0.43 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.349 0.595 . . . . 0.0 111.092 -179.13 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.58 ' H ' ' CG ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -51.92 -86.47 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.585 -179.669 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.422 ' CB ' ' NZ ' ' A' ' 64' ' ' LYS . 0.6 OUTLIER 53.74 -177.75 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.396 179.73 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.66 ' OE1' ' N ' ' A' ' 65' ' ' GLU . 1.8 mp0 -73.03 148.35 89.03 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.504 ' O ' ' C ' ' A' ' 67' ' ' SER . 11.3 Cg_endo -56.37 -146.34 0.0 OUTLIER 'Trans proline' 0 C--N 1.302 -1.912 0 C-N-CA 122.424 2.083 . . . . 0.0 111.53 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.504 ' C ' ' O ' ' A' ' 66' ' ' PRO . 11.7 p 31.5 39.65 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.846 0.355 . . . . 0.0 110.622 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 66' ' ' PRO . 2.2 tt0 -172.06 13.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.323 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -76.81 -23.91 52.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.141 0.496 . . . . 0.0 110.855 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -153.86 134.47 13.62 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.521 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.91 149.18 33.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.573 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.602 ' O ' ' OG1' ' A' ' 73' ' ' THR . . . -103.61 -40.19 6.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.218 0.533 . . . . 0.0 109.98 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.602 ' OG1' ' O ' ' A' ' 72' ' ' ALA . 99.6 m -176.67 -37.67 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.669 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.612 ' O ' ' O ' ' A' ' 75' ' ' PRO . 30.2 mt-10 -82.15 149.62 62.81 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.844 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.612 ' O ' ' O ' ' A' ' 74' ' ' GLU . 42.4 Cg_exo -48.29 -138.91 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.719 2.279 . . . . 0.0 112.592 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.4 p -76.96 175.32 9.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.412 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -46.07 -77.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.397 0.618 . . . . 0.0 110.368 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 1.074 HG22 ' H ' ' A' ' 79' ' ' GLU . 9.9 p -113.68 -147.83 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.383 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 1.074 ' H ' HG22 ' A' ' 78' ' ' VAL . 0.0 OUTLIER -98.6 -59.85 1.66 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.811 0.338 . . . . 0.0 110.641 -179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 124.98 -36.97 2.68 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 21.4 m -133.62 179.38 6.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.771 0.319 . . . . 0.0 110.574 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -46.36 171.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.745 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -93.33 160.19 14.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.7 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.6 m-20 -120.59 14.69 11.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.481 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 166.86 12.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.309 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -60.65 -17.65 48.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.103 0.477 . . . . 0.0 110.271 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 2.7 t -145.6 152.94 13.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.135 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.986 HD23 ' O ' ' A' ' 88' ' ' LEU . 6.1 tt -71.31 -26.74 62.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.138 0.494 . . . . 0.0 110.471 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.749 ' HB3' ' O ' ' A' ' 88' ' ' LEU . . . 84.01 -7.92 1.03 Allowed 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.052 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.88 ' O ' HD22 ' A' ' 88' ' ' LEU . 0.0 OUTLIER -167.58 113.72 0.73 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.402 179.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.636 HG13 ' N ' ' A' ' 92' ' ' ILE . 5.4 p 179.26 -54.49 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 1.018 HG22 ' H ' ' A' ' 93' ' ' ASP . 19.5 mt 56.46 -170.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.536 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 1.018 ' H ' HG22 ' A' ' 92' ' ' ILE . 26.7 t0 73.1 96.75 0.07 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.205 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.095 HD23 ' H ' ' A' ' 95' ' ' THR . 1.1 pt? -137.41 -49.05 0.59 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.403 0.62 . . . . 0.0 110.789 -179.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 1.095 ' H ' HD23 ' A' ' 94' ' ' LEU . 3.0 t -68.8 115.07 7.72 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.363 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -123.77 -166.98 1.55 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.645 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.92 -175.12 5.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.45 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -81.13 -20.26 41.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.985 0.421 . . . . 0.0 110.638 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.477 ' C ' ' N ' ' A' ' 101' ' ' ASP . 0.3 OUTLIER -94.46 10.19 35.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.564 -179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.536 ' C ' ' OD1' ' A' ' 100' ' ' ASP . 34.4 p30 -48.3 -14.15 0.05 Allowed 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.027 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.535 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 0.1 OUTLIER -59.81 -61.57 2.52 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.056 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.117 HD23 ' N ' ' A' ' 103' ' ' GLN . 0.5 OUTLIER -83.23 -28.83 28.94 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.486 179.458 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 1.117 ' N ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -63.26 -39.03 93.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.912 0.863 . . . . 0.0 109.364 -179.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' A' ' 100' ' ' ASP . . . -80.31 -54.64 5.54 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.141 -1.39 . . . . 0.0 111.169 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.41 -44.34 76.13 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.351 0.596 . . . . 0.0 109.471 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.668 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -67.37 -41.86 86.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.364 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -66.31 -41.51 89.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.677 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -38.97 89.6 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.178 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.65 -18.04 34.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.098 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 1.028 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? -97.02 -11.41 24.54 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.791 -179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.644 ' C ' ' H ' ' A' ' 113' ' ' SER . 20.2 mt -121.81 -170.43 2.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.349 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 63.13 -23.01 0.06 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.765 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.644 ' H ' ' C ' ' A' ' 111' ' ' LEU . 13.9 m -136.94 136.66 21.49 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.841 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -76.68 -175.01 2.38 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 C-N-CA 122.525 2.15 . . . . 0.0 111.907 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.535 ' H ' ' CD ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -111.82 -165.69 1.01 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.774 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 1.011 HG22 ' H ' ' A' ' 117' ' ' GLN . 8.9 mt -144.06 -153.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.232 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 1.011 ' H ' HG22 ' A' ' 116' ' ' ILE . 0.0 OUTLIER -68.08 81.8 0.22 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.416 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -55.91 -166.87 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.466 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.9 -78.37 0.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.579 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.801 0 CA-C-O 117.972 -1.46 . . . . 0.0 110.995 179.921 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.1 m -157.22 135.28 11.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.663 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.59 -176.63 4.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.27 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.463 ' O ' ' O ' ' A' ' 5' ' ' LEU . 22.4 tp10 56.8 -120.19 1.37 Allowed 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.279 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.463 ' O ' ' O ' ' A' ' 4' ' ' GLU . 0.2 OUTLIER -48.67 -178.92 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.199 179.699 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.496 ' C ' ' H ' ' A' ' 8' ' ' ASP . 0.0 OUTLIER -130.51 -127.37 0.2 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.806 0.336 . . . . 0.0 110.744 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 74.39 -19.1 0.38 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.15 0.5 . . . . 0.0 110.227 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.496 ' H ' ' C ' ' A' ' 6' ' ' GLN . 0.3 OUTLIER -110.54 -20.17 12.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.342 179.503 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -43.38 -20.67 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.458 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.482 ' N ' ' O ' ' A' ' 8' ' ' ASP . . . -58.51 -8.56 1.27 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.59 -177.58 6.65 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.461 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 116.23 165.34 14.17 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -139.37 170.32 16.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.877 0.37 . . . . 0.0 110.632 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.66 27.4 1.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.577 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.661 ' OD1' ' N ' ' A' ' 16' ' ' GLY . 13.1 t70 42.77 -120.83 0.6 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.803 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.661 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 95.73 -128.34 9.49 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.534 ' N ' ' ND1' ' A' ' 17' ' ' HIS . 0.9 OUTLIER -112.91 101.18 9.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.759 0.314 . . . . 0.0 110.542 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -88.76 -172.3 46.39 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.99 9.66 6.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.755 0.312 . . . . 0.0 110.638 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.9 p -112.88 175.67 5.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.328 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 m -134.56 100.74 4.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.867 0.365 . . . . 0.0 110.754 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.625 ' O ' HD13 ' A' ' 25' ' ' LEU . 83.9 mt-30 -82.36 -14.1 55.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.559 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.649 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -69.09 -21.63 64.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.488 -179.138 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.597 ' O ' ' CD2' ' A' ' 28' ' ' LEU . 71.1 mt -65.46 -66.24 0.57 Allowed 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.831 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.873 HD22 ' C ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -67.64 -34.85 77.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.296 179.819 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.812 ' H ' HD13 ' A' ' 25' ' ' LEU . 16.8 t-20 -65.77 -41.8 91.63 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.299 0.571 . . . . 0.0 110.082 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.649 ' CG ' ' O ' ' A' ' 23' ' ' MET . 30.2 mm-40 -61.49 -55.52 30.26 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.621 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.751 ' HB2' HD22 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -52.6 -55.08 24.86 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 119.429 -0.908 . . . . 0.0 110.594 -179.386 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.426 ' CD ' ' C ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -63.54 -21.63 66.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.352 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -87.64 -20.32 26.5 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.462 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.0 mt -97.43 -53.53 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-O 121.529 0.68 . . . . 0.0 111.085 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.516 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.1 p -77.85 -36.65 49.69 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.95 -178.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.2 35.78 52.33 Favored Glycine 0 CA--C 1.519 0.288 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.919 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.8 mm -92.72 155.64 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.118 0.485 . . . . 0.0 111.68 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.43 ' N ' HG22 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -118.9 23.2 11.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.41 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.919 ' H ' HG22 ' A' ' 34' ' ' ILE . 4.5 m-20 -125.27 75.94 68.3 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.46 -0.337 . . . . 0.0 110.979 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.559 ' HA ' HD12 ' A' ' 40' ' ' LEU . 85.6 Cg_exo -39.26 -20.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.597 2.198 . . . . 0.0 111.563 179.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.575 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -73.67 -53.89 9.37 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.541 -1.209 . . . . 0.0 111.676 -179.407 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.986 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.94 -25.6 62.81 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.569 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.751 HD22 ' HB2' ' A' ' 28' ' ' LEU . 9.6 mt -64.74 -54.68 27.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.457 ' CD2' ' O ' ' A' ' 41' ' ' HIS . 5.6 t-160 -57.81 -30.59 65.84 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 114.878 -1.055 . . . . 0.0 110.088 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -63.18 -44.35 95.63 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.025 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -65.82 -42.36 90.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.259 179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.632 ' CD2' HD13 ' A' ' 28' ' ' LEU . 4.4 mm? -62.5 -31.97 72.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.146 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.31 -29.39 34.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.183 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.44 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -77.45 -42.48 35.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.393 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.633 ' OG ' ' HB2' ' A' ' 54' ' ' ALA . 0.2 OUTLIER -72.41 14.13 0.27 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.653 0.263 . . . . 0.0 111.007 -179.39 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.691 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.7 OUTLIER 60.42 26.32 15.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.473 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.27 -23.38 34.54 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 111.705 -0.558 . . . . 0.0 111.705 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -61.48 127.52 31.9 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.595 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.4 OUTLIER -77.56 -57.63 5.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 C-N-CA 120.749 -0.381 . . . . 0.0 111.125 -179.066 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.595 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 14.4 m -47.84 -45.98 30.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.065 0.46 . . . . 0.0 110.506 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 41.8 mt-30 -61.71 -55.8 26.46 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.633 ' HB2' ' OG ' ' A' ' 47' ' ' SER . . . -41.47 -58.29 1.94 Allowed 'General case' 0 CA--C 1.508 -0.658 0 CA-C-O 122.139 0.971 . . . . 0.0 108.511 178.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.881 ' O ' HG22 ' A' ' 59' ' ' THR . 18.1 t -43.56 -54.38 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 CA-C-N 113.613 -1.63 . . . . 0.0 108.754 178.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.432 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 4.5 t -52.43 -44.95 65.74 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.612 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.664 ' O ' ' NE ' ' A' ' 62' ' ' ARG . 16.9 mt -57.45 -34.59 69.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.26 0.552 . . . . 0.0 110.888 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.025 HD21 ' HB2' ' A' ' 43' ' ' ALA . 13.8 mt -87.84 -26.89 22.57 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 113.742 1.015 . . . . 0.0 113.742 -177.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.881 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -105.96 3.79 28.77 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.094 -0.643 . . . . 0.0 111.26 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.479 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.4 OUTLIER -65.49 30.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.881 -179.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.611 ' H ' ' C ' ' A' ' 59' ' ' THR . 3.1 tp10 75.58 66.7 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.559 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.664 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -133.64 -73.63 0.49 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.156 0.503 . . . . 0.0 111.751 -179.297 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.573 ' O ' ' O ' ' A' ' 64' ' ' LYS . 84.0 t -63.5 -92.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.558 -178.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.573 ' O ' ' O ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER 35.87 -163.55 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.29 -179.191 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -177.82 76.18 0.23 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.031 0.443 . . . . 0.0 110.806 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.572 ' O ' ' O ' ' A' ' 67' ' ' SER . 12.1 Cg_exo -66.98 -77.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.76 0 C-N-CA 122.85 2.367 . . . . 0.0 111.925 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.572 ' O ' ' O ' ' A' ' 66' ' ' PRO . 5.4 p -26.68 150.04 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.922 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -76.05 135.81 39.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.5 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.69 -18.49 29.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.206 0.527 . . . . 0.0 110.613 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.567 ' OG1' ' N ' ' A' ' 71' ' ' VAL . 1.5 t -77.62 -119.98 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.479 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.666 HG23 ' N ' ' A' ' 72' ' ' ALA . 13.7 m -69.24 -138.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.369 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.666 ' N ' HG23 ' A' ' 71' ' ' VAL . . . -138.59 -37.99 0.53 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.489 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.586 ' C ' ' O ' ' A' ' 72' ' ' ALA . 21.6 m 11.08 -119.5 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.31 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.594 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.2 OUTLIER -45.11 144.06 2.21 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.476 -179.969 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -74.42 179.74 5.59 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 122.65 2.233 . . . . 0.0 112.187 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.62 -176.95 3.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.576 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -94.81 -102.56 0.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.097 0.475 . . . . 0.0 110.784 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.413 HG12 ' H ' ' A' ' 79' ' ' GLU . 1.6 t -148.94 -137.67 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.576 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.413 ' H ' HG12 ' A' ' 78' ' ' VAL . 11.3 mt-10 -132.25 -42.18 0.98 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -153.84 101.26 0.21 Allowed Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.58 -175.55 1.68 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.822 0.344 . . . . 0.0 110.456 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -49.85 -76.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.571 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -176.94 -131.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.671 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -98.95 9.41 43.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.395 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 87' ' ' VAL . 37.2 tttp -94.44 -91.91 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 110.792 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.493 ' C ' HG23 ' A' ' 87' ' ' VAL . 4.9 pt-20 33.12 28.9 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.948 179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.613 ' N ' ' O ' ' A' ' 85' ' ' LYS . 88.2 t -158.32 142.47 6.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.817 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.531 ' N ' HD12 ' A' ' 88' ' ' LEU . 9.1 mp -89.89 -36.9 14.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.417 0.627 . . . . 0.0 109.972 179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 57.51 75.68 0.36 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.268 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.42 ' O ' ' HB ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER 56.61 -143.42 0.71 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.108 179.086 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.722 ' O ' HG12 ' A' ' 91' ' ' VAL . 25.7 t 64.47 78.86 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.539 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.467 ' O ' ' O ' ' A' ' 91' ' ' VAL . 23.3 pt -42.38 168.76 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.472 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.461 ' O ' HD22 ' A' ' 94' ' ' LEU . 10.4 t0 175.26 94.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.395 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.461 HD22 ' O ' ' A' ' 93' ' ' ASP . 0.6 OUTLIER -123.99 -86.58 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.77 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.521 ' O ' ' OG1' ' A' ' 95' ' ' THR . 0.0 OUTLIER -111.56 53.24 0.72 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.629 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -143.45 -21.52 0.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.138 0.494 . . . . 0.0 110.398 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -144.61 66.74 1.26 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.578 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.4 ' OD1' ' C ' ' A' ' 98' ' ' ASN . 17.5 p30 -96.24 153.85 17.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.546 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.597 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -141.53 0.49 1.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.85 -179.755 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.54 ' O ' ' HB3' ' A' ' 104' ' ' ALA . 8.1 m-20 -44.56 -14.65 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.741 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.597 ' N ' ' O ' ' A' ' 99' ' ' LYS . 12.0 t70 -61.12 -60.92 3.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.311 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.108 HD23 ' N ' ' A' ' 103' ' ' GLN . 0.4 OUTLIER -83.42 -29.04 28.43 Favored 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 120.244 -0.582 . . . . 0.0 110.705 179.786 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 1.108 ' N ' HD23 ' A' ' 102' ' ' LEU . 0.1 OUTLIER -64.4 -40.72 96.34 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 119.529 -0.869 . . . . 0.0 109.341 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 100' ' ' ASP . . . -79.74 -55.59 4.89 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.919 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.88 -46.61 71.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.159 0.504 . . . . 0.0 109.669 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.686 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.3 mm -62.58 -47.93 90.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.996 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.29 98.58 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.223 -178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -41.02 98.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.831 0.348 . . . . 0.0 110.548 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -18.37 36.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.091 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.994 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.2 tm? -93.73 -12.05 30.08 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.528 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.72 -29.1 25.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.592 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.5 ' O ' ' CB ' ' A' ' 113' ' ' SER . 54.1 mm-40 -90.91 -94.12 0.13 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.552 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 112' ' ' GLU . 1.9 t 81.37 115.39 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.706 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -76.28 -176.16 2.93 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.231 1.954 . . . . 0.0 112.068 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -123.98 151.62 43.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.627 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -91.2 -169.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.358 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -118.0 39.59 3.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.691 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.39 -111.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.392 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.557 ' CG ' ' N ' ' A' ' 120' ' ' GLY . 7.9 t70 -154.15 -104.41 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.587 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.557 ' N ' ' CG ' ' A' ' 119' ' ' ASP . . . . . . . . 0 C--O 1.22 -0.741 0 CA-C-O 118.0 -1.445 . . . . 0.0 110.821 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.462 ' HB ' HD23 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -88.78 -166.33 1.57 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.822 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.8 -36.58 3.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.186 0.517 . . . . 0.0 110.527 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -84.84 -116.33 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.611 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.82 ' N ' HD22 ' A' ' 5' ' ' LEU . 2.9 mm? 51.87 178.99 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.371 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -158.7 53.46 0.42 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.569 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -76.0 3.65 9.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.506 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.433 ' O ' ' C ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -95.17 -18.6 20.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.544 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.675 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 1.8 p-10 -35.66 -61.54 0.46 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.963 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.675 ' N ' ' CG ' ' A' ' 9' ' ' ASP . . . 32.89 99.08 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.252 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -113.79 120.36 40.52 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.903 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -99.88 128.79 9.69 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ASP . . . -104.02 -165.78 1.19 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.816 0.341 . . . . 0.0 110.43 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.548 ' O ' ' C ' ' A' ' 15' ' ' ASP . . . -67.43 72.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.301 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.548 ' C ' ' O ' ' A' ' 14' ' ' ALA . 2.2 m-20 -25.53 -75.61 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.759 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 140.38 -9.06 2.93 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -79.9 150.86 30.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.788 0.328 . . . . 0.0 110.41 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 138.06 121.92 2.02 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.6 t -87.62 176.83 7.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.733 0.301 . . . . 0.0 110.537 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.3 t -150.15 113.01 4.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.464 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.506 ' C ' ' H ' ' A' ' 23' ' ' MET . 0.1 OUTLIER -128.07 145.61 50.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.956 0.408 . . . . 0.0 110.825 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -47.2 -12.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.644 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.744 ' N ' ' SD ' ' A' ' 23' ' ' MET . 0.0 OUTLIER -65.68 -47.86 74.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.147 0.499 . . . . 0.0 110.907 -179.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.476 ' H ' HD12 ' A' ' 24' ' ' LEU . 3.6 mp -61.98 -48.59 79.67 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.071 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.941 HD22 ' H ' ' A' ' 25' ' ' LEU . 1.9 mm? -62.53 -52.96 61.4 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.158 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -53.4 -45.97 69.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.379 0.609 . . . . 0.0 110.118 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' N ' ' A' ' 30' ' ' GLU . 2.6 mm-40 -57.32 -58.77 6.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.835 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.962 HD22 ' CD2' ' A' ' 44' ' ' LEU . 12.4 tp -44.68 -54.27 6.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.97 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -63.03 -24.16 67.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.374 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 27' ' ' GLN . 29.6 tt0 -79.29 -21.21 46.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.998 0.428 . . . . 0.0 110.398 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.448 HG21 HG11 ' A' ' 55' ' ' VAL . 59.4 mt -93.96 -44.29 13.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.383 0.611 . . . . 0.0 111.215 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.533 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.1 p -91.44 -37.45 13.18 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.312 -178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.444 ' O ' ' OE1' ' A' ' 79' ' ' GLU . . . 86.99 34.77 10.48 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.651 -0.979 . . . . 0.0 110.651 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.64 HG21 ' CD1' ' A' ' 39' ' ' PHE . 1.1 mm -100.09 142.27 15.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.773 0.321 . . . . 0.0 110.39 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.629 HE22 ' C ' ' A' ' 79' ' ' GLU . 2.9 mp0 -113.85 23.29 13.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.792 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.635 ' O ' ' N ' ' A' ' 38' ' ' SER . 36.4 t0 -112.52 72.51 1.31 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.396 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -34.96 -22.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.691 0 C-N-CA 122.877 2.385 . . . . 0.0 112.336 -179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.635 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.8 OUTLIER -73.68 -52.66 12.55 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.938 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 1.075 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -72.26 -26.01 61.83 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 179.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.643 HD23 HD23 ' A' ' 28' ' ' LEU . 1.2 mp -71.91 -53.17 13.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -60.72 -24.92 66.05 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.128 178.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -65.79 -46.11 79.93 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.922 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -61.53 -51.52 68.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.071 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.962 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.3 mm? -55.04 -36.27 65.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.207 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 4.4 tmtt? -76.54 -28.74 56.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.446 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.469 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -83.32 -20.88 33.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.914 0.388 . . . . 0.0 110.735 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.42 ' OG ' ' HB2' ' A' ' 53' ' ' GLN . 42.2 t -93.02 -6.83 47.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.381 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.695 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.2 OUTLIER 74.75 26.54 1.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.055 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.12 -21.59 41.07 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.35 123.64 20.93 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.73 ' O ' HG23 ' A' ' 55' ' ' VAL . 2.2 tt -75.56 -56.03 9.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.036 -179.15 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.639 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.2 m -46.09 -52.34 12.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.809 0.337 . . . . 0.0 110.662 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.615 ' O ' HD12 ' A' ' 57' ' ' LEU . 28.1 mt-30 -59.64 -53.68 55.23 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.997 -0.681 . . . . 0.0 109.37 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.0 -53.52 2.95 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.855 ' O ' HG22 ' A' ' 59' ' ' THR . 39.5 t -47.73 -58.73 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.949 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.2 t -46.02 -48.53 16.74 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.249 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.665 ' O ' ' NE ' ' A' ' 62' ' ' ARG . 6.6 mp -62.53 -27.64 69.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.199 0.523 . . . . 0.0 111.02 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.075 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 52.6 mt -90.31 -14.02 34.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.853 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.855 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -118.2 -0.22 11.6 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.329 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.531 ' H ' ' HD3' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -64.63 27.14 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.771 0.32 . . . . 0.0 110.598 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.656 ' H ' ' C ' ' A' ' 59' ' ' THR . 1.0 OUTLIER 79.52 36.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.362 179.448 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.665 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -91.64 -52.21 4.87 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 121.329 0.585 . . . . 0.0 110.379 179.409 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.534 HG12 ' N ' ' A' ' 64' ' ' LYS . 48.6 t -95.01 -107.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.589 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.534 ' N ' HG12 ' A' ' 63' ' ' VAL . 0.0 OUTLIER 173.72 -105.04 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.517 179.046 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.883 ' H ' ' CD ' ' A' ' 66' ' ' PRO . 0.0 OUTLIER 177.23 -18.43 0.0 OUTLIER Pre-proline 0 CA--C 1.546 0.81 0 N-CA-C 114.22 1.193 . . . . 0.0 114.22 -179.302 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.883 ' CD ' ' H ' ' A' ' 65' ' ' GLU . 51.3 Cg_exo -55.2 -151.8 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.221 0 C-N-CA 121.953 1.769 . . . . 0.0 112.893 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.654 ' OG ' ' N ' ' A' ' 68' ' ' GLN . 5.1 t 169.01 -166.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.587 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.654 ' N ' ' OG ' ' A' ' 67' ' ' SER . 9.7 mt-30 -127.75 171.56 11.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.906 0.384 . . . . 0.0 110.7 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -68.38 -18.54 64.49 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.238 0.542 . . . . 0.0 110.501 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.1 p -107.54 -170.31 1.68 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.572 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.906 HG22 ' H ' ' A' ' 72' ' ' ALA . 3.0 p -81.76 -150.8 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.739 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.906 ' H ' HG22 ' A' ' 71' ' ' VAL . . . -122.65 -64.73 1.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.215 0.531 . . . . 0.0 110.988 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.404 ' CB ' ' O ' ' A' ' 72' ' ' ALA . 0.2 OUTLIER 75.99 -70.32 0.14 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.466 -179.878 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.525 ' H ' ' HD2' ' A' ' 75' ' ' PRO . 6.2 mt-10 -153.75 -63.32 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.504 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.525 ' HD2' ' H ' ' A' ' 74' ' ' GLU . 17.8 Cg_endo -59.41 -95.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 122.743 2.295 . . . . 0.0 111.991 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 6.9 t 61.02 -179.86 0.11 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.637 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.567 ' N ' ' OE1' ' A' ' 68' ' ' GLN . 29.5 mm-40 -106.07 -37.88 6.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.464 0.649 . . . . 0.0 110.31 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 1.005 HG22 ' H ' ' A' ' 79' ' ' GLU . 8.9 p -152.63 -131.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.74 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 1.005 ' H ' HG22 ' A' ' 78' ' ' VAL . 7.3 mt-10 -60.9 -128.59 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.941 -0.303 . . . . 0.0 110.479 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.571 ' N ' HE22 ' A' ' 35' ' ' GLN . . . -174.41 10.12 0.03 OUTLIER Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.83 -0.908 . . . . 0.0 110.83 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 90.5 p -76.05 -172.56 2.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.919 0.39 . . . . 0.0 110.641 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.4 137.61 58.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.74 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -105.68 167.13 9.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.183 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.571 ' O ' ' O ' ' A' ' 85' ' ' LYS . 1.5 m-20 -110.67 35.7 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.783 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.571 ' O ' ' O ' ' A' ' 84' ' ' ASN . 2.1 ttmm -52.74 -120.26 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.924 0.392 . . . . 0.0 110.725 179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.486 ' H ' ' HG2' ' A' ' 85' ' ' LYS . 14.5 tt0 -64.98 -83.63 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.584 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -125.43 157.98 34.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.635 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.486 HD23 ' O ' ' A' ' 89' ' ' ALA . 7.1 tt -70.22 -27.72 64.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.603 0.716 . . . . 0.0 109.509 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.486 ' O ' HD23 ' A' ' 88' ' ' LEU . . . 61.02 174.46 0.11 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.324 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.417 ' HG3' ' H ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -127.25 -177.97 4.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.647 -179.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.646 ' O ' HG12 ' A' ' 91' ' ' VAL . 75.2 t -140.77 69.98 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.403 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.3 pt -81.47 135.26 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.361 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.5 t70 179.63 105.49 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.164 0.506 . . . . 0.0 110.377 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 28.3 mt -142.63 -89.17 0.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.111 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.523 HG23 ' O ' ' A' ' 95' ' ' THR . 2.4 t -121.75 90.09 3.24 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.325 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -86.64 -28.45 23.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.024 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.401 ' O ' ' C ' ' A' ' 98' ' ' ASN . 12.3 t70 -94.2 61.28 2.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.528 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.401 ' C ' ' O ' ' A' ' 97' ' ' ASP . 0.2 OUTLIER -38.89 136.89 0.72 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.562 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 103' ' ' GLN . 2.0 pttt -140.18 -86.99 0.2 Allowed 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.469 0.652 . . . . 0.0 110.976 -179.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.485 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 2.3 m-20 -67.92 -25.18 65.35 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.329 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.37 -60.72 3.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.312 -179.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.906 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -81.39 -22.52 38.24 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.233 -0.587 . . . . 0.0 111.73 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.889 ' N ' HD22 ' A' ' 102' ' ' LEU . 6.4 mt-30 -66.71 -40.84 88.61 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.677 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.95 -53.22 9.37 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.362 -1.29 . . . . 0.0 111.026 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.68 -51.52 68.43 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.663 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -55.38 -45.01 77.93 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.938 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.45 ' O ' ' CB ' ' A' ' 111' ' ' LEU . . . -68.89 -31.04 69.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.136 -179.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.84 -28.0 63.27 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.013 0.435 . . . . 0.0 109.854 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.7 -18.66 16.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.334 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 106' ' ' ILE . 4.7 tt -97.92 -16.77 19.58 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.571 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.45 ' CB ' ' O ' ' A' ' 107' ' ' ALA . 2.9 tt -101.22 -23.65 14.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.753 -179.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.549 ' O ' ' C ' ' A' ' 113' ' ' SER . 0.3 OUTLIER -121.11 -20.29 6.84 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.764 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.549 ' C ' ' O ' ' A' ' 112' ' ' GLU . 0.9 OUTLIER 22.12 78.74 0.2 Allowed Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.148 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.98 -157.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.774 2.316 . . . . 0.0 112.013 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 6.6 mptt -87.11 -117.43 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.286 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 116' ' ' ILE . 1.3 mt -142.77 160.1 18.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.388 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.424 ' O ' ' O ' ' A' ' 118' ' ' ALA . 15.2 mt-30 -104.12 42.06 1.23 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.519 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.448 ' O ' ' OD1' ' A' ' 119' ' ' ASP . . . 40.79 -162.52 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.476 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 118' ' ' ALA . 1.0 OUTLIER -162.93 -91.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.59 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.691 0 CA-C-O 117.999 -1.445 . . . . 0.0 111.038 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ptt? . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.448 HG23 ' N ' ' A' ' 3' ' ' ALA . 2.8 t -158.96 -171.21 3.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.439 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.448 ' N ' HG23 ' A' ' 2' ' ' THR . . . -78.17 -149.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.693 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -61.31 -178.2 0.11 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.813 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.827 ' H ' HD22 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -90.69 178.56 6.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.434 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.554 ' C ' ' O ' ' A' ' 5' ' ' LEU . 3.5 mt-30 26.83 94.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.574 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -63.26 -120.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.042 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 43.7 t0 -44.71 -26.54 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.036 0.446 . . . . 0.0 111.151 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.55 -20.77 58.02 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.709 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.83 -121.12 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.771 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.45 89.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.439 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.43 120.53 0.61 Allowed Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -94.73 158.4 15.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.798 0.333 . . . . 0.0 110.507 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' GLY . . . -77.77 -145.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.521 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.48 ' C ' ' O ' ' A' ' 14' ' ' ALA . 89.0 m-20 -32.1 -36.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.526 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 14' ' ' ALA . . . 130.66 -4.21 5.79 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.821 -0.912 . . . . 0.0 110.821 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -107.74 143.39 36.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.801 0.334 . . . . 0.0 110.628 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 159.53 143.3 3.62 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.961 -0.855 . . . . 0.0 110.961 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.9 m -110.95 -59.58 1.95 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.813 0.339 . . . . 0.0 110.613 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -46.37 147.07 1.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.611 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.8 t -118.6 145.49 45.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.64 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.532 ' N ' ' OE1' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -48.01 -22.57 0.62 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.759 -179.857 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 14.7 mtt -69.73 -22.86 63.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.974 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 mp -70.61 -62.88 1.22 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.329 0.585 . . . . 0.0 110.517 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.849 HD23 ' H ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -62.84 -35.89 81.43 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.241 179.711 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -62.2 -55.83 24.64 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.215 0.531 . . . . 0.0 110.139 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 30' ' ' GLU . 0.3 OUTLIER -52.56 -60.55 3.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.649 179.263 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.88 HD23 HD23 ' A' ' 40' ' ' LEU . 11.1 tp -46.45 -51.86 14.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.554 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ttt180 -60.91 -21.29 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.437 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.467 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.3 tt0 -86.43 -24.25 25.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.438 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.48 HD12 ' HA ' ' A' ' 28' ' ' LEU . 31.3 mt -87.26 -53.35 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 CA-C-O 121.889 0.852 . . . . 0.0 110.537 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.496 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.7 p -82.63 -37.29 25.16 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.048 -1.433 . . . . 0.0 111.675 -178.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.28 35.34 17.96 Favored Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.138 -1.185 . . . . 0.0 110.138 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.694 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.2 mm -99.41 142.42 15.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.893 0.378 . . . . 0.0 110.827 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -112.96 23.35 13.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.46 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.694 ' H ' HG22 ' A' ' 34' ' ' ILE . 15.2 m-20 -112.39 73.94 1.46 Allowed Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.441 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_exo -35.36 -24.25 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.605 2.203 . . . . 0.0 112.021 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.611 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.7 OUTLIER -71.88 -52.98 14.64 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.258 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 1.032 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -70.99 -25.21 62.6 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 179.766 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.88 HD23 HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -71.84 -47.84 50.27 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.771 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -65.26 -26.96 68.32 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.123 178.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.51 -53.77 42.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.903 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -59.69 -38.37 81.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.261 179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.75 ' CD2' HD22 ' A' ' 28' ' ' LEU . 3.3 mm? -67.36 -30.12 69.84 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.934 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.489 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -77.26 -33.94 55.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.11 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.489 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -81.86 -37.9 26.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.749 -179.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 48' ' ' ASN . 32.0 p -67.53 -12.75 61.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.757 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.411 ' CB ' ' O ' ' A' ' 47' ' ' SER . 0.2 OUTLIER 74.03 37.79 0.61 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.685 179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 93.83 -23.58 30.25 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -67.71 125.61 26.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.833 0.349 . . . . 0.0 110.281 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.633 ' CG2' ' N ' ' A' ' 52' ' ' THR . 0.6 OUTLIER -78.02 -57.47 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -179.636 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.633 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 18.5 m -45.39 -53.04 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.937 0.399 . . . . 0.0 110.568 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.68 ' O ' HD12 ' A' ' 57' ' ' LEU . 44.9 mt-30 -55.69 -55.33 33.47 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.283 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.412 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.33 -54.04 3.12 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 121.586 0.708 . . . . 0.0 109.149 179.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.635 ' O ' HG22 ' A' ' 59' ' ' THR . 61.6 t -47.57 -56.96 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.635 178.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -51.28 -46.67 62.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.306 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.68 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.1 mp -60.2 -34.54 73.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.058 0.456 . . . . 0.0 111.327 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.032 HD22 ' CE2' ' A' ' 39' ' ' PHE . 18.8 mt -81.44 -58.18 3.14 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.428 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.693 ' O ' ' N ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -82.21 5.52 19.59 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.672 -178.797 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.576 ' C ' ' O ' ' A' ' 59' ' ' THR . 0.5 OUTLIER -28.12 -35.51 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.568 0.699 . . . . 0.0 109.54 179.808 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.693 ' N ' ' O ' ' A' ' 59' ' ' THR . 2.5 pm0 -132.76 -39.23 0.98 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.19 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.659 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 1.4 tpt180 174.19 -67.8 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.757 179.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.658 ' N ' ' OE2' ' A' ' 61' ' ' GLU . 0.9 OUTLIER 175.51 -23.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.789 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.471 ' N ' ' CD ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -134.06 -157.02 0.78 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.933 0.397 . . . . 0.0 111.086 -179.84 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.441 ' N ' ' HG2' ' A' ' 64' ' ' LYS . 80.0 mt-10 -105.4 77.24 0.36 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.381 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -64.84 -47.51 4.99 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.139 1.893 . . . . 0.0 112.216 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 m -78.95 108.35 12.36 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.38 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -127.81 144.71 51.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.769 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -90.84 -19.42 23.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.281 0.562 . . . . 0.0 110.518 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.7 p -110.7 132.84 53.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.539 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.642 ' CG2' ' N ' ' A' ' 72' ' ' ALA . 1.5 p -161.64 171.5 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.407 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.642 ' N ' ' CG2' ' A' ' 71' ' ' VAL . . . -77.95 -45.51 23.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.054 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.659 ' OG1' ' N ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -110.5 -159.5 0.68 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.422 -179.494 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.659 ' N ' ' OG1' ' A' ' 73' ' ' THR . 5.7 mm-40 -31.77 130.66 0.29 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.975 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.608 ' O ' ' O ' ' A' ' 74' ' ' GLU . 52.8 Cg_exo -48.27 -151.87 0.0 OUTLIER 'Trans proline' 0 N--CA 1.493 1.488 0 C-N-CA 122.483 2.122 . . . . 0.0 112.348 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.512 ' O ' ' O ' ' A' ' 75' ' ' PRO . 8.5 t -45.62 179.78 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.665 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.427 ' C ' HG23 ' A' ' 78' ' ' VAL . 2.9 mp0 -68.07 -7.29 28.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.737 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.733 HG12 ' H ' ' A' ' 79' ' ' GLU . 19.5 t -153.12 174.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.568 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.733 ' H ' HG12 ' A' ' 78' ' ' VAL . 4.7 mm-40 -82.1 -158.11 0.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.622 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -62.86 120.2 20.45 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.21 169.41 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.859 0.361 . . . . 0.0 110.525 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -46.42 134.35 9.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.693 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.614 ' C ' HD22 ' A' ' 84' ' ' ASN . . . -148.25 158.7 44.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.584 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.614 HD22 ' C ' ' A' ' 83' ' ' ALA . 1.6 m-80 -139.87 19.83 2.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.743 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.504 ' C ' ' H ' ' A' ' 87' ' ' VAL . 13.9 tttm -45.81 177.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.31 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.535 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 13.1 tt0 -61.64 2.45 0.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.647 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.541 HG12 ' H ' ' A' ' 89' ' ' ALA . 2.8 t -124.58 150.4 29.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.171 0.51 . . . . 0.0 110.734 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.57 ' H ' HD12 ' A' ' 88' ' ' LEU . 5.3 mp -81.51 -23.74 37.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.241 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.541 ' H ' HG12 ' A' ' 87' ' ' VAL . . . 56.69 22.65 7.03 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.462 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.854 ' O ' HG13 ' A' ' 91' ' ' VAL . 0.0 OUTLIER -147.25 147.27 30.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.146 -179.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.854 HG13 ' O ' ' A' ' 90' ' ' LYS . 3.2 m -167.95 77.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.279 179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.525 ' C ' ' O ' ' A' ' 91' ' ' VAL . 1.2 pt -29.94 129.29 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.597 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.627 ' C ' ' H ' ' A' ' 95' ' ' THR . 18.6 t0 178.03 41.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.146 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.451 ' C ' ' CG2' ' A' ' 95' ' ' THR . 0.2 OUTLIER 70.51 -17.97 0.26 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.577 0.703 . . . . 0.0 109.936 -179.797 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.627 ' H ' ' C ' ' A' ' 93' ' ' ASP . 0.1 OUTLIER 35.89 92.2 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.668 -1.151 . . . . 0.0 111.004 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.46 ' CG ' ' H ' ' A' ' 97' ' ' ASP . 0.4 OUTLIER -68.33 -115.43 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.335 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.46 ' H ' ' CG ' ' A' ' 96' ' ' HIS . 0.2 OUTLIER -94.21 150.23 20.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.466 179.688 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.422 ' N ' ' OD1' ' A' ' 98' ' ' ASN . 1.6 m120 -135.09 144.61 47.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.617 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -157.76 -12.68 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.498 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.495 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 3.8 p30 -45.1 -17.02 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.843 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.515 ' N ' ' O ' ' A' ' 99' ' ' LYS . 2.0 t70 -63.51 -59.3 4.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.963 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.961 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.5 pp -76.25 -32.03 58.66 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.364 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.961 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.9 OUTLIER -63.41 -38.49 91.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.724 0.774 . . . . 0.0 109.508 -179.028 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.51 -56.41 4.64 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.595 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.64 -55.02 29.51 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.667 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.6 mm -51.89 -52.96 19.72 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.754 179.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.86 73.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.057 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.774 HD23 ' O ' ' A' ' 108' ' ' LEU . 8.6 tt -58.18 -32.52 68.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.884 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.06 -18.14 22.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.984 0.421 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.981 ' O ' HD12 ' A' ' 110' ' ' LEU . 1.1 tp -88.53 -17.83 29.43 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.71 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.7 tp -82.41 -24.57 34.3 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.138 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.588 ' O ' ' C ' ' A' ' 113' ' ' SER . 1.9 mt-10 -138.54 -96.82 0.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.524 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.588 ' C ' ' O ' ' A' ' 112' ' ' GLU . 1.6 m -13.37 100.02 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.438 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -79.84 -94.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.737 2.292 . . . . 0.0 112.469 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.5 ptpp? -100.82 -170.5 1.86 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.124 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.406 HG21 HD13 ' A' ' 116' ' ' ILE . 0.9 OUTLIER -114.89 169.51 5.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.763 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.406 ' H ' HG22 ' A' ' 116' ' ' ILE . 0.3 OUTLIER -78.75 24.58 0.29 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.744 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.4 ' H ' ' C ' ' A' ' 116' ' ' ILE . . . -117.84 -179.6 3.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.529 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -149.37 -57.9 0.2 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.754 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.784 0 CA-C-O 118.011 -1.438 . . . . 0.0 110.911 179.946 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 mtt . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.7 t -115.24 -163.98 0.92 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.751 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -153.25 -140.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.497 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.537 ' C ' HD13 ' A' ' 5' ' ' LEU . 15.2 mt-10 -64.11 158.96 21.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.44 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.976 ' N ' HD22 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -106.13 -153.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.927 0.394 . . . . 0.0 110.783 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -139.47 -168.69 2.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.273 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.43 ' HG2' ' N ' ' A' ' 8' ' ' ASP . 38.2 tt0 -130.7 -118.8 0.22 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.463 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.43 ' N ' ' HG2' ' A' ' 7' ' ' GLN . 0.2 OUTLIER -62.88 -18.57 63.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.993 0.425 . . . . 0.0 110.438 179.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.454 ' O ' ' C ' ' A' ' 10' ' ' ALA . 49.5 t0 -44.78 -47.48 10.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.716 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.571 ' O ' ' O ' ' A' ' 11' ' ' ALA . . . 33.0 -130.13 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.905 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.571 ' O ' ' O ' ' A' ' 10' ' ' ALA . . . -35.03 163.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.86 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -162.14 153.77 24.54 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -145.87 -127.76 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.816 0.341 . . . . 0.0 110.498 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.547 ' O ' ' O ' ' A' ' 15' ' ' ASP . . . -139.39 128.69 24.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.51 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.547 ' O ' ' O ' ' A' ' 14' ' ' ALA . 8.1 m-20 -36.05 161.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.222 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -109.85 41.46 2.23 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -149.68 24.53 0.87 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.817 0.342 . . . . 0.0 110.473 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -93.69 54.71 2.32 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.453 ' OG ' ' N ' ' A' ' 20' ' ' SER . 4.1 t -104.74 -99.02 0.32 Allowed 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.939 -0.305 . . . . 0.0 110.515 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.453 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.4 OUTLIER 68.11 176.65 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.616 179.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.685 ' O ' HD21 ' A' ' 24' ' ' LEU . 0.8 OUTLIER -127.59 167.6 16.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.817 -179.719 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.418 ' HB3' HD11 ' A' ' 25' ' ' LEU . 36.1 mm-40 -81.76 -13.43 57.76 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.02 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 28.7 mtt -54.17 -32.07 54.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.846 0.355 . . . . 0.0 111.484 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.685 HD21 ' O ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -68.7 -60.93 2.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.685 -179.115 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.819 HD12 ' N ' ' A' ' 26' ' ' ASN . 1.8 pp -62.76 -38.93 92.52 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.948 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.819 ' N ' HD12 ' A' ' 25' ' ' LEU . 0.2 OUTLIER -63.81 -58.32 7.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.236 0.541 . . . . 0.0 110.757 -179.853 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -53.49 -59.02 5.13 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.948 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.756 HD13 HD21 ' A' ' 44' ' ' LEU . 6.6 tp -52.88 -57.93 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.908 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -59.4 -21.52 60.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.29 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -83.2 -35.01 25.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.826 0.346 . . . . 0.0 110.769 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.612 HG21 HG11 ' A' ' 55' ' ' VAL . 38.6 mt -73.0 -52.41 22.34 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-O 121.659 0.743 . . . . 0.0 110.684 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.477 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 6.0 p -79.74 -35.32 39.02 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.331 -1.304 . . . . 0.0 111.609 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 67.28 36.15 89.11 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.074 -1.21 . . . . 0.0 110.074 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.812 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -89.32 155.71 3.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.256 -0.472 . . . . 0.0 111.705 -178.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -122.26 23.35 9.83 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.608 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.812 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -119.77 70.09 13.41 Favored Pre-proline 0 C--N 1.328 -0.359 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_exo -34.83 -20.83 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.962 2.441 . . . . 0.0 112.221 -178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.669 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -73.73 -52.43 13.23 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.869 -1.06 . . . . 0.0 110.632 179.66 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.953 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.33 -25.38 64.18 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.514 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 1.2 mt -69.61 -59.79 2.74 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.723 ' HD1' ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -57.51 -27.57 62.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.447 179.136 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.723 ' N ' ' HD1' ' A' ' 41' ' ' HIS . 62.9 tt0 -61.3 -56.77 16.74 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.67 179.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.935 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -58.56 -38.7 78.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.435 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.756 HD21 HD13 ' A' ' 28' ' ' LEU . 2.0 mm? -67.59 -24.9 65.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.96 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.449 ' HG2' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -81.43 -30.59 33.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.179 179.237 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.449 ' N ' ' HG2' ' A' ' 45' ' ' LYS . . . -82.07 -36.95 27.12 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.813 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.584 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 41.4 t -72.58 -16.24 61.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.744 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 73.6 36.38 0.78 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.956 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.66 -23.69 35.13 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.584 ' O ' ' OG ' ' A' ' 47' ' ' SER . 0.4 OUTLIER -66.97 116.08 7.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.943 ' O ' HG23 ' A' ' 55' ' ' VAL . 1.7 tt -70.15 -50.88 43.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.408 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.638 ' N ' HG23 ' A' ' 51' ' ' ILE . 54.4 m -50.87 -61.44 2.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.289 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.721 ' O ' HD12 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -49.85 -56.24 11.19 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.047 -0.661 . . . . 0.0 109.887 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.05 -55.18 2.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.943 HG23 ' O ' ' A' ' 51' ' ' ILE . 21.4 t -47.24 -58.57 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.746 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.6 t -48.47 -50.08 32.97 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.721 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.0 mp -55.4 -36.78 66.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.196 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.953 HD22 ' CE2' ' A' ' 39' ' ' PHE . 25.5 mt -80.5 -62.21 1.74 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.941 -178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.647 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -71.77 -2.14 16.51 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.542 -178.33 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.55 ' C ' ' O ' ' A' ' 59' ' ' THR . 19.2 t0 -26.39 -50.78 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.913 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 179.91 49.14 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.114 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.666 ' CG ' ' O ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -132.29 -101.89 0.27 Allowed 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.133 0.492 . . . . 0.0 110.467 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.958 HG23 ' H ' ' A' ' 64' ' ' LYS . 12.9 m -61.83 -66.14 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.406 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.958 ' H ' HG23 ' A' ' 63' ' ' VAL . 2.1 pttp 31.73 -158.89 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.874 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.491 ' N ' ' HD3' ' A' ' 66' ' ' PRO . 0.8 OUTLIER 168.65 59.42 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.786 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.491 ' HD3' ' N ' ' A' ' 65' ' ' GLU . 94.3 Cg_endo -85.21 -155.46 0.06 OUTLIER 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.983 2.455 . . . . 0.0 112.466 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 m -121.69 99.76 6.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.207 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -122.96 -22.81 5.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.115 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.587 ' O ' ' O ' ' A' ' 70' ' ' THR . 3.4 t0 -79.45 -23.21 43.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.047 0.451 . . . . 0.0 110.985 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.587 ' O ' ' O ' ' A' ' 69' ' ' ASP . 7.8 p 52.2 130.89 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.768 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.643 ' CG2' ' N ' ' A' ' 72' ' ' ALA . 0.3 OUTLIER -161.2 164.95 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.348 0.594 . . . . 0.0 110.985 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.643 ' N ' ' CG2' ' A' ' 71' ' ' VAL . . . -55.82 -99.55 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.134 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.775 HG22 ' H ' ' A' ' 74' ' ' GLU . 3.7 m -52.22 178.6 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.453 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.775 ' H ' HG22 ' A' ' 73' ' ' THR . 21.0 tp10 63.23 80.27 0.25 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.319 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -45.66 160.75 0.15 Allowed 'Trans proline' 0 C--N 1.305 -1.75 0 C-N-CA 122.787 2.324 . . . . 0.0 111.864 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.44 155.68 39.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.5 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -68.64 -6.29 25.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.558 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 1.016 HG12 ' H ' ' A' ' 79' ' ' GLU . 3.9 t -134.1 -147.73 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.82 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 1.016 ' H ' HG12 ' A' ' 78' ' ' VAL . 1.5 pt-20 -126.37 -154.51 0.63 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.617 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.06 61.65 1.56 Allowed Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.081 -0.808 . . . . 0.0 111.081 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.581 ' O ' ' O ' ' A' ' 82' ' ' ALA . 97.9 p -119.89 -170.19 1.91 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.787 0.327 . . . . 0.0 110.642 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.581 ' O ' ' O ' ' A' ' 81' ' ' SER . . . -48.97 -167.62 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.53 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -138.54 -166.03 1.92 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.56 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.404 ' H ' ' H ' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -152.28 -6.06 0.22 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.244 179.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.404 ' H ' ' H ' ' A' ' 84' ' ' ASN . 4.1 mtpp -42.92 164.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.444 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -179.53 79.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.459 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -146.49 131.7 12.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.768 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.0 tt -59.93 -27.9 67.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.302 0.573 . . . . 0.0 110.207 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 60.83 -87.52 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.353 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.03 -169.12 0.08 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.646 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 1.017 HG13 ' H ' ' A' ' 92' ' ' ILE . 4.2 p -95.69 -99.06 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.675 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 1.017 ' H ' HG13 ' A' ' 91' ' ' VAL . 1.9 pt -142.33 179.6 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.421 ' CB ' ' O ' ' A' ' 92' ' ' ILE . 16.7 t0 75.53 90.87 0.08 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.028 0.442 . . . . 0.0 110.393 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.038 HD23 ' H ' ' A' ' 95' ' ' THR . 0.4 OUTLIER -109.99 -49.24 3.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.559 0.695 . . . . 0.0 110.357 -179.657 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 1.038 ' H ' HD23 ' A' ' 94' ' ' LEU . 30.9 m -162.62 65.22 0.21 Allowed 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.643 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.412 ' CG ' ' O ' ' A' ' 95' ' ' THR . 14.2 m-70 -166.84 159.01 13.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.734 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 176.21 81.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.365 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.691 ' O ' ' N ' ' A' ' 101' ' ' ASP . 8.5 m-20 -128.96 -25.97 2.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.159 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.791 ' O ' HD23 ' A' ' 102' ' ' LEU . 3.3 ptpp? 19.06 -95.28 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.004 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.95 -40.34 63.58 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.654 -0.418 . . . . 0.0 111.335 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.691 ' N ' ' O ' ' A' ' 98' ' ' ASN . 0.3 OUTLIER -52.87 -59.42 4.53 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.008 HD23 ' H ' ' A' ' 103' ' ' GLN . 0.9 OUTLIER -77.18 -34.76 56.25 Favored 'General case' 0 C--O 1.21 -0.976 0 C-N-CA 120.304 -0.559 . . . . 0.0 112.425 -178.441 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 1.008 ' H ' HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -63.22 -35.66 81.08 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.806 0.812 . . . . 0.0 109.561 -178.766 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.68 -56.57 4.2 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.442 -1.253 . . . . 0.0 110.775 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.62 -47.7 73.12 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.518 0.675 . . . . 0.0 109.289 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.675 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.8 mm -61.08 -46.72 96.1 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.612 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.771 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 103' ' ' GLN . . . -60.39 -45.7 92.62 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.85 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.3 tp -59.62 -43.33 93.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.647 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.0 -19.17 34.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.245 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.963 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? -87.55 -15.87 36.21 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 26.8 tp -65.77 -28.3 68.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.519 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.483 ' O ' ' O ' ' A' ' 113' ' ' SER . 4.0 mm-40 -115.35 -102.11 0.42 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.156 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.483 ' O ' ' O ' ' A' ' 112' ' ' GLU . 0.0 OUTLIER -39.65 165.22 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.502 179.854 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -75.18 -168.68 0.54 Allowed 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 122.863 2.376 . . . . 0.0 112.372 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.23 -149.98 0.46 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.395 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 1.1 mt -102.03 170.01 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.391 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -106.0 70.37 0.85 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.678 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -77.12 -139.99 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.516 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.45 -105.96 0.38 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.57 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.777 0 CA-C-O 117.994 -1.448 . . . . 0.0 110.849 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttm . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.63 102.76 14.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.648 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -115.36 -174.43 2.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.286 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.735 ' HB3' HD13 ' A' ' 5' ' ' LEU . 1.1 tp10 69.61 -83.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.502 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.03 ' H ' HD13 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -80.06 -174.34 4.42 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.515 179.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.645 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -138.48 175.96 9.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.908 0.385 . . . . 0.0 110.663 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.556 ' O ' ' N ' ' A' ' 10' ' ' ALA . 3.1 mp0 -100.26 -88.39 0.35 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.439 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -43.53 -21.56 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.778 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.44 ' N ' ' C ' ' A' ' 7' ' ' GLN . 0.7 OUTLIER -90.71 -28.91 18.01 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.698 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.645 ' HB3' ' O ' ' A' ' 6' ' ' GLN . . . -111.17 130.41 55.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.38 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.77 177.77 4.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.651 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 47.09 -113.62 1.3 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -130.83 171.63 12.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.765 0.317 . . . . 0.0 110.433 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.49 159.99 22.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.541 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.97 -167.25 1.46 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.342 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -106.95 99.53 1.45 Allowed Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.684 ' ND1' ' N ' ' A' ' 18' ' ' GLY . 4.9 p80 -47.53 -33.0 5.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.729 0.3 . . . . 0.0 110.651 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.684 ' N ' ' ND1' ' A' ' 17' ' ' HIS . . . 179.01 -164.09 32.14 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' A' ' 20' ' ' SER . 4.9 p -118.2 -139.24 0.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.788 0.328 . . . . 0.0 110.499 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.597 ' N ' ' OG ' ' A' ' 19' ' ' SER . 10.8 t -156.65 137.93 13.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.701 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.5 167.88 9.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.47 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.624 ' O ' ' CD1' ' A' ' 25' ' ' LEU . 9.1 mt-30 -80.0 -18.44 50.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.372 0.606 . . . . 0.0 110.245 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.602 ' N ' ' SD ' ' A' ' 23' ' ' MET . 0.1 OUTLIER -70.96 -19.19 62.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.572 -179.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.684 ' O ' ' CD2' ' A' ' 28' ' ' LEU . 10.0 mp -68.54 -65.84 0.65 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.469 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.037 HD13 ' H ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -65.64 -33.92 77.01 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.587 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 1.037 ' H ' HD13 ' A' ' 25' ' ' LEU . 6.3 t-20 -64.57 -40.95 96.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.173 0.511 . . . . 0.0 109.986 178.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.441 ' CG ' ' O ' ' A' ' 23' ' ' MET . 10.3 mm100 -65.59 -63.66 1.04 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.6 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.816 HD22 HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -51.33 -48.72 62.33 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 119.807 -0.757 . . . . 0.0 110.479 -179.392 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.75 -22.35 65.23 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.141 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.609 ' CG ' ' O ' ' A' ' 26' ' ' ASN . 15.2 mm-40 -85.86 -20.86 28.48 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.981 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 94.1 mt -94.49 -38.8 9.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 CA-C-O 121.6 0.714 . . . . 0.0 110.927 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 28' ' ' LEU . 11.4 p -94.89 -35.39 12.05 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.794 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.74 36.0 58.39 Favored Glycine 0 CA--C 1.519 0.311 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.842 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -93.72 152.22 3.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.246 -0.477 . . . . 0.0 111.237 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -120.73 23.59 10.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.035 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.842 ' H ' HG22 ' A' ' 34' ' ' ILE . 10.2 t70 -120.16 74.24 21.08 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.5 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.551 ' HA ' HD12 ' A' ' 40' ' ' LEU . 66.7 Cg_exo -37.28 -20.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.666 2.244 . . . . 0.0 111.683 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.633 ' O ' ' ND1' ' A' ' 41' ' ' HIS . 0.7 OUTLIER -69.95 -54.0 15.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.506 -1.224 . . . . 0.0 111.549 -179.449 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.923 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -74.42 -26.39 60.04 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 10.6 mt -63.08 -46.88 85.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.633 ' ND1' ' O ' ' A' ' 38' ' ' SER . 0.9 OUTLIER -67.57 -36.42 80.89 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.796 179.174 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.571 ' N ' ' CD2' ' A' ' 41' ' ' HIS . 4.9 tt0 -51.89 -49.12 63.62 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.551 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.049 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -69.29 -56.83 6.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.564 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.816 HD21 HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -45.33 -25.79 0.44 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.407 ' N ' ' C ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -83.78 -49.38 9.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.347 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.422 ' C ' ' H ' ' A' ' 48' ' ' ASN . . . -64.12 -41.98 97.02 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.75 0.309 . . . . 0.0 110.968 -179.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 50' ' ' ASP . 6.8 p -68.09 4.65 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.809 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 46' ' ' ALA . 3.2 m-80 56.48 33.22 22.16 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.7 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.79 -23.6 35.27 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.472 ' O ' ' OG ' ' A' ' 47' ' ' SER . 11.7 m-20 -62.45 106.13 0.72 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.649 HG22 ' N ' ' A' ' 52' ' ' THR . 0.1 OUTLIER -63.78 -58.4 7.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.691 -179.379 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.649 ' N ' HG22 ' A' ' 51' ' ' ILE . 23.1 m -43.89 -46.19 7.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.122 0.487 . . . . 0.0 110.336 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.662 ' O ' HD12 ' A' ' 57' ' ' LEU . 1.8 mp0 -64.74 -53.54 45.53 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -42.02 -54.02 3.68 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 178.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.947 ' O ' HG22 ' A' ' 59' ' ' THR . 69.1 t -46.72 -58.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.126 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -48.86 -46.98 43.13 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.98 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.9 mp -62.27 -34.3 76.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.132 0.491 . . . . 0.0 111.413 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.049 HD21 ' HB2' ' A' ' 43' ' ' ALA . 18.9 mt -87.89 -14.1 40.26 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -177.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.947 HG22 ' O ' ' A' ' 55' ' ' VAL . 1.4 t -132.82 13.06 4.39 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 119.523 -0.871 . . . . 0.0 112.887 -179.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.634 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 7.5 t70 -64.29 14.13 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.106 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.648 ' H ' ' C ' ' A' ' 59' ' ' THR . 14.8 tt0 93.59 63.48 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.062 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.536 ' O ' ' C ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER -146.66 -60.68 0.3 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.019 -178.49 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.708 HG12 ' N ' ' A' ' 64' ' ' LYS . 2.3 t -25.09 -71.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.67 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.708 ' N ' HG12 ' A' ' 63' ' ' VAL . 0.1 OUTLIER 39.79 -172.59 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.109 -179.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.483 ' C ' ' O ' ' A' ' 64' ' ' LYS . 27.9 mt-10 -33.57 94.9 0.08 OUTLIER Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.424 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.498 ' N ' ' O ' ' A' ' 64' ' ' LYS . 16.9 Cg_exo -63.5 -151.69 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.55 0 C-N-CA 122.579 2.186 . . . . 0.0 112.611 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.559 ' O ' ' OG ' ' A' ' 67' ' ' SER . 2.9 p 55.6 64.41 1.76 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.143 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 69' ' ' ASP . 1.6 pp0? -129.1 -30.48 2.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.817 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 68' ' ' GLN . 3.3 t0 -94.26 -20.25 19.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.162 0.506 . . . . 0.0 110.827 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.576 ' O ' ' O ' ' A' ' 71' ' ' VAL . 30.1 p -96.59 150.95 20.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.446 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.605 ' O ' ' O ' ' A' ' 72' ' ' ALA . 0.4 OUTLIER -32.15 155.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.405 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.605 ' O ' ' O ' ' A' ' 71' ' ' VAL . . . -37.27 -107.53 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.24 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.535 HG22 ' HD2' ' A' ' 75' ' ' PRO . 0.2 OUTLIER 78.47 -172.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.161 -179.404 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.604 ' H ' ' HD2' ' A' ' 75' ' ' PRO . 2.1 mt-10 -116.45 -53.33 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.308 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.028 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.604 ' HD2' ' H ' ' A' ' 74' ' ' GLU . 84.1 Cg_endo -87.46 -105.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 122.9 2.4 . . . . 0.0 112.142 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.6 t -142.0 178.6 7.41 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.385 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.445 ' OE1' ' OD1' ' A' ' 36' ' ' ASP . 12.4 mt-10 -41.48 -83.44 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.728 0.775 . . . . 0.0 110.407 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 1.039 HG22 ' H ' ' A' ' 79' ' ' GLU . 9.9 p -81.57 -150.67 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.45 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 1.039 ' H ' HG22 ' A' ' 78' ' ' VAL . 0.7 OUTLIER -86.48 154.62 20.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.424 179.837 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 128.74 141.71 5.22 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 82' ' ' ALA . 31.6 m -145.78 -176.57 5.19 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.585 ' O ' ' O ' ' A' ' 81' ' ' SER . . . -53.39 -148.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -46.24 157.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.408 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -86.29 22.29 1.84 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.277 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 86' ' ' GLU . 1.9 pttt -129.03 166.65 18.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.614 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 27.7 tt0 176.71 31.8 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.998 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.606 HG12 ' H ' ' A' ' 89' ' ' ALA . 13.5 t -151.0 154.95 7.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.567 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.563 ' O ' ' O ' ' A' ' 89' ' ' ALA . 4.0 mp -107.75 -25.45 11.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.603 179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.606 ' H ' HG12 ' A' ' 87' ' ' VAL . . . 50.09 118.11 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.969 179.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.624 ' O ' HG23 ' A' ' 91' ' ' VAL . 0.0 OUTLIER -150.83 155.79 39.92 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.205 -179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 90' ' ' LYS . 72.3 t -161.17 83.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.396 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -87.41 138.09 19.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.47 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -177.78 111.44 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.567 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.954 HD23 ' H ' ' A' ' 94' ' ' LEU . 1.6 pt? -131.66 -48.41 0.97 Allowed 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.449 0.642 . . . . 0.0 110.934 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.595 ' N ' ' HG ' ' A' ' 94' ' ' LEU . 10.5 t -66.77 139.9 57.82 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.782 -1.099 . . . . 0.0 110.794 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.661 ' NE2' ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER 174.32 -176.39 0.08 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.426 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 43.87 89.14 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.841 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.533 HD22 HE22 ' A' ' 103' ' ' GLN . 11.7 p-10 -97.94 148.94 22.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.187 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 103' ' ' GLN . 3.1 tppt? -141.65 148.92 39.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.235 0.541 . . . . 0.0 111.278 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.422 ' O ' ' CB ' ' A' ' 104' ' ' ALA . 1.9 p30 -59.47 -14.76 13.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.214 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.92 -62.7 1.67 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.925 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.038 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.77 -20.56 30.83 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.845 179.027 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.891 ' N ' HD22 ' A' ' 102' ' ' LEU . 3.2 mt-30 -68.34 -35.63 78.05 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.422 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -81.06 -49.66 10.61 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.352 -1.295 . . . . 0.0 110.61 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.92 -42.27 97.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.674 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.0 mm -65.07 -50.04 76.45 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.792 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.436 ' O ' HD13 ' A' ' 111' ' ' LEU . . . -61.08 -47.92 84.1 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.9 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 25.9 tp -58.43 -43.69 88.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.771 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.91 -18.94 38.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.175 -179.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.452 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 2.4 tt -87.07 -16.04 36.76 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.424 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 107' ' ' ALA . 1.5 mp -75.84 -19.59 58.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.482 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -118.17 -19.57 8.97 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.778 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.404 ' OG ' ' HD2' ' A' ' 114' ' ' PRO . 0.1 OUTLIER 63.55 162.62 0.12 Allowed Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.697 179.725 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.404 ' HD2' ' OG ' ' A' ' 113' ' ' SER . 73.0 Cg_exo -43.02 168.16 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.924 2.416 . . . . 0.0 112.547 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.94 -73.13 0.43 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.433 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.87 HG22 ' N ' ' A' ' 117' ' ' GLN . 55.2 mt -116.85 -117.27 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.525 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.87 ' N ' HG22 ' A' ' 116' ' ' ILE . 0.9 OUTLIER -110.17 31.43 5.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.472 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -75.46 -96.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.618 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.24 -35.72 80.15 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.37 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.788 0 CA-C-O 118.009 -1.439 . . . . 0.0 110.966 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.09 -159.52 1.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.522 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.546 ' O ' ' N ' ' A' ' 5' ' ' LEU . . . -115.75 -57.96 2.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.191 0.519 . . . . 0.0 110.577 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.468 ' C ' ' O ' ' A' ' 3' ' ' ALA . 0.9 OUTLIER -33.37 -33.63 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.372 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.611 HD23 ' N ' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -112.12 -178.64 3.47 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.365 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.61 ' N ' ' CD ' ' A' ' 6' ' ' GLN . 13.1 mp0 -81.62 149.61 28.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.918 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -112.8 -5.27 13.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.371 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 9' ' ' ASP . 1.1 m-20 -100.1 -21.29 15.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.322 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.435 ' C ' ' O ' ' A' ' 8' ' ' ASP . 7.9 t70 -36.65 -63.89 0.38 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.42 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.52 -168.84 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.331 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -158.76 -161.7 1.0 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.814 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 97.87 -82.31 0.66 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.81 -33.61 24.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.318 0.58 . . . . 0.0 110.562 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 42.83 -148.33 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.456 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -120.61 -86.62 0.65 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.58 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -94.14 -1.11 65.13 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -86.35 114.76 23.4 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.814 0.34 . . . . 0.0 110.631 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -79.33 -147.22 3.96 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.6 m -138.77 122.36 17.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.89 0.376 . . . . 0.0 110.656 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.2 t -178.36 147.11 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.428 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.88 134.75 36.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.611 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.71 -14.74 59.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.474 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.1 mtm -67.31 -23.84 65.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.518 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.488 ' O ' HD11 ' A' ' 51' ' ' ILE . 10.0 mt -66.78 -63.8 0.99 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.982 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.481 HD23 ' H ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -64.85 -34.9 79.46 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.951 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.427 ' C ' HD22 ' A' ' 26' ' ' ASN . 0.6 OUTLIER -61.88 -53.36 56.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.085 0.469 . . . . 0.0 110.241 179.582 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.553 ' O ' ' N ' ' A' ' 30' ' ' GLU . 12.3 mm-40 -55.99 -60.19 3.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.548 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.852 HD23 HD23 ' A' ' 40' ' ' LEU . 15.9 tp -45.42 -49.84 12.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.411 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 1.1 tmt_? -63.27 -20.57 65.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.161 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 27' ' ' GLN . 4.8 tp10 -84.39 -22.07 30.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.127 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.516 HD12 ' HA ' ' A' ' 28' ' ' LEU . 13.7 mt -92.5 -52.98 9.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.727 0.775 . . . . 0.0 110.72 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.444 ' OG1' HG13 ' A' ' 34' ' ' ILE . 9.7 p -81.76 -36.8 28.12 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.336 -1.302 . . . . 0.0 111.378 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 29' ' ' ARG . . . 79.14 35.78 29.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.703 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.1 mm -98.57 140.66 17.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.989 0.423 . . . . 0.0 111.201 -178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -112.06 22.64 14.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.318 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.703 ' H ' HG22 ' A' ' 34' ' ' ILE . 4.4 t70 -110.67 74.44 0.92 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.979 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -35.88 -25.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.723 2.282 . . . . 0.0 112.393 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.548 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -68.9 -53.11 22.94 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.321 -179.668 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 1.056 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -73.17 -24.97 60.62 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.154 0.502 . . . . 0.0 109.652 -179.794 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.852 HD23 HD23 ' A' ' 28' ' ' LEU . 0.6 OUTLIER -69.67 -51.43 34.74 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.625 179.279 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.03 -24.97 63.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.94 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -68.31 -39.16 82.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.955 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -68.93 -55.68 10.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.446 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.84 ' CD1' HD22 ' A' ' 28' ' ' LEU . 7.5 mp -53.86 -36.75 62.95 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.25 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -53.99 37.15 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.56 -24.89 50.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.74 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.58 -7.65 49.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 65.88 39.01 4.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.811 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.53 -23.39 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.517 ' C ' ' OD1' ' A' ' 50' ' ' ASP . 16.4 t0 -64.17 93.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.651 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.5 tt -50.59 -57.87 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.143 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.651 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 38.6 m -42.07 -53.46 3.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.98 0.419 . . . . 0.0 110.28 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.656 ' O ' HD12 ' A' ' 57' ' ' LEU . 2.2 mt-30 -57.04 -53.89 52.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.209 179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.538 ' HB1' HD12 ' A' ' 44' ' ' LEU . . . -40.38 -57.3 1.81 Allowed 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.615 HG22 HD12 ' A' ' 28' ' ' LEU . 40.3 t -46.62 -60.75 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.856 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -42.39 -49.71 5.17 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.741 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.656 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.3 mp -60.43 -36.66 78.7 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.696 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.056 HD22 ' CE2' ' A' ' 39' ' ' PHE . 11.5 mt -90.84 -11.01 40.61 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.171 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.535 ' C ' ' H ' ' A' ' 61' ' ' GLU . 82.2 p -107.74 -6.33 16.87 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.624 -179.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.588 ' C ' ' HE ' ' A' ' 62' ' ' ARG . 0.5 OUTLIER -66.19 38.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.104 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.712 ' C ' ' HE ' ' A' ' 62' ' ' ARG . 26.1 tt0 69.32 75.88 0.23 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.384 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.712 ' HE ' ' C ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -131.07 -97.38 0.34 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.766 179.862 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.93 -38.52 78.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.304 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.0 tptm 72.36 -178.81 0.21 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.032 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -121.14 90.22 47.09 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.836 0.35 . . . . 0.0 110.907 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.567 ' O ' ' O ' ' A' ' 67' ' ' SER . 73.0 Cg_endo -84.37 -155.96 0.07 OUTLIER 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 123.13 2.553 . . . . 0.0 112.149 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.567 ' O ' ' O ' ' A' ' 66' ' ' PRO . 4.3 p 31.51 -156.69 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.84 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -140.78 -149.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.576 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.612 ' O ' ' O ' ' A' ' 70' ' ' THR . 4.1 m-20 -111.9 -19.21 12.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.979 0.418 . . . . 0.0 110.733 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.612 ' O ' ' O ' ' A' ' 69' ' ' ASP . 64.4 p -15.44 -109.98 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.607 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.436 ' N ' ' OG1' ' A' ' 70' ' ' THR . 7.0 m -140.84 -169.07 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.676 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.543 ' O ' ' C ' ' A' ' 73' ' ' THR . . . -106.04 -31.54 8.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.388 0.613 . . . . 0.0 109.801 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.543 ' C ' ' O ' ' A' ' 72' ' ' ALA . 89.4 m -24.55 -78.2 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.631 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.552 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.6 OUTLIER -127.6 145.19 53.81 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.316 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -69.48 150.42 69.92 Favored 'Trans proline' 0 C--N 1.306 -1.661 0 C-N-CA 122.649 2.233 . . . . 0.0 112.207 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.612 ' O ' ' N ' ' A' ' 78' ' ' VAL . 33.8 t -146.0 34.43 1.01 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.756 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' A' ' 76' ' ' SER . 38.7 mt-10 -32.37 -31.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.11 0.481 . . . . 0.0 110.782 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 1.05 HG13 ' H ' ' A' ' 79' ' ' GLU . 2.6 p -151.91 -91.9 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.232 -179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 1.05 ' H ' HG13 ' A' ' 78' ' ' VAL . 59.1 mt-10 -21.48 144.28 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.344 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -169.6 158.37 30.61 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.9 p -116.23 177.43 4.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.929 0.395 . . . . 0.0 110.97 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.38 -111.95 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.001 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.608 ' C ' ' H ' ' A' ' 85' ' ' LYS . . . -147.52 -164.45 2.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.589 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.83 4.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.48 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.608 ' H ' ' C ' ' A' ' 83' ' ' ALA . 8.9 mtpt -72.36 170.91 13.19 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.93 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.578 ' O ' ' CG ' ' A' ' 86' ' ' GLU . 15.3 tt0 -119.66 1.45 11.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.096 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.99 HG12 ' H ' ' A' ' 88' ' ' LEU . 4.5 t -123.45 -174.74 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.496 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.99 ' H ' HG12 ' A' ' 87' ' ' VAL . 30.0 tp -110.25 -30.79 7.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.557 0.694 . . . . 0.0 110.004 179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 88' ' ' LEU . . . 80.21 169.43 0.16 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.551 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.468 ' HB2' ' HZ2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -99.09 121.09 40.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 111.028 -179.576 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.651 ' O ' HG13 ' A' ' 91' ' ' VAL . 2.3 p -176.45 27.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.749 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.485 ' C ' ' O ' ' A' ' 91' ' ' VAL . 0.5 OUTLIER -34.38 139.51 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.341 179.783 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 174.08 90.91 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.289 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.438 ' HA ' HD22 ' A' ' 94' ' ' LEU . 1.0 OUTLIER -96.97 -90.46 0.26 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.555 -179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.569 ' O ' ' O ' ' A' ' 96' ' ' HIS . 10.0 t -149.63 -138.34 0.09 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.702 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.569 ' O ' ' O ' ' A' ' 95' ' ' THR . 0.1 OUTLIER -48.9 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.357 179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.464 ' O ' ' OD1' ' A' ' 98' ' ' ASN . 4.7 m-20 -146.54 69.59 1.19 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.481 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.533 ' N ' HD12 ' A' ' 102' ' ' LEU . 36.6 m-20 -141.61 145.27 34.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.867 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.528 ' CG ' ' H ' ' A' ' 100' ' ' ASP . 0.8 OUTLIER 80.51 -143.67 0.01 OUTLIER 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.341 0.591 . . . . 0.0 112.098 178.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.528 ' H ' ' CG ' ' A' ' 99' ' ' LYS . 0.9 OUTLIER -70.81 -21.77 62.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.015 -179.175 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -55.47 -60.57 3.23 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.834 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.8 HD22 ' N ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -83.5 -24.83 31.55 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.069 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.8 ' N ' HD22 ' A' ' 102' ' ' LEU . 1.8 mt-30 -68.08 -39.89 82.82 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 118.992 -1.083 . . . . 0.0 109.3 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -51.57 9.03 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.744 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.14 78.73 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 5.4 mm -61.55 -57.98 9.62 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.788 179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -51.85 -44.68 63.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 110.921 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.5 tp -59.3 -40.96 87.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.715 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.04 -17.13 36.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.413 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.958 ' O ' HD12 ' A' ' 110' ' ' LEU . 0.9 OUTLIER -89.96 -16.57 29.63 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.687 -179.401 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.66 -24.27 23.96 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.642 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.91 -18.8 49.66 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.888 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.574 ' O ' ' OG ' ' A' ' 113' ' ' SER . 2.0 t 51.0 48.09 5.49 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.251 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.54 ' CD ' ' N ' ' A' ' 113' ' ' SER . 68.4 Cg_endo -75.09 -170.32 0.77 Allowed 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.844 2.363 . . . . 0.0 112.447 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 8.6 ptmt -112.79 -172.74 2.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.072 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.77 HG22 ' N ' ' A' ' 117' ' ' GLN . 49.0 mt -106.3 -121.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.524 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.77 ' N ' HG22 ' A' ' 116' ' ' ILE . 4.0 tt0 -128.92 20.56 5.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.377 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 40.49 -117.73 0.31 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.549 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -123.21 -92.29 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.523 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.735 0 CA-C-O 118.024 -1.431 . . . . 0.0 110.887 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 mtp . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.03 164.22 24.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.473 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.581 ' O ' ' C ' ' A' ' 4' ' ' GLU . . . -132.47 -113.81 0.23 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.829 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.581 ' C ' ' O ' ' A' ' 3' ' ' ALA . 0.4 OUTLIER 4.04 -83.27 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.71 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.075 HD23 ' H ' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -59.22 -114.12 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.544 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -99.32 -171.51 2.09 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.523 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -124.06 -111.74 0.31 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.034 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -76.75 -22.14 54.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.263 0.554 . . . . 0.0 110.112 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -38.82 -76.21 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.833 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -145.81 -179.03 6.42 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.677 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -144.76 161.93 38.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.447 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.539 ' O ' ' C ' ' A' ' 13' ' ' ALA . . . 156.31 -132.26 3.26 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.539 ' C ' ' O ' ' A' ' 12' ' ' GLY . . . 27.86 -145.84 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.705 0.288 . . . . 0.0 110.607 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -97.05 -178.12 4.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.63 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -118.76 -65.3 1.19 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.475 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.06 -79.48 0.18 Allowed Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.44 ' C ' ' H ' ' A' ' 19' ' ' SER . 8.9 t-160 59.34 56.46 3.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.794 0.331 . . . . 0.0 110.657 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.84 -18.59 2.35 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' A' ' 20' ' ' SER . 3.5 p 40.83 -145.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.844 0.354 . . . . 0.0 110.71 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.531 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.6 OUTLIER -84.17 -170.14 2.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.63 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.7 m -86.47 101.26 13.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.366 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.446 ' O ' ' CB ' ' A' ' 26' ' ' ASN . 1.6 tt0 -81.87 -12.91 58.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.074 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 5.2 mtt -63.34 -49.34 74.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.223 0.535 . . . . 0.0 111.425 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.732 HD13 HD12 ' A' ' 51' ' ' ILE . 4.6 mm? -58.11 -61.44 2.55 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.258 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.581 HD22 ' CE1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -58.7 -48.92 79.48 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.436 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.446 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 4.8 t-20 -53.42 -55.25 26.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.22 0.533 . . . . 0.0 110.399 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -56.7 -56.55 19.97 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.158 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.902 HD22 ' CD2' ' A' ' 44' ' ' LEU . 40.8 tp -47.77 -55.99 8.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.696 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -62.1 -25.99 68.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.897 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.419 ' N ' ' HG3' ' A' ' 29' ' ' ARG . 10.4 mt-10 -76.54 -27.29 55.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.026 0.441 . . . . 0.0 110.375 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.607 HG21 HG11 ' A' ' 55' ' ' VAL . 54.4 mt -85.1 -43.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-O 121.787 0.803 . . . . 0.0 110.618 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 28' ' ' LEU . 7.7 p -90.6 -34.73 15.36 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.302 -1.317 . . . . 0.0 111.469 -178.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 81.71 35.36 22.5 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.761 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -94.95 148.47 5.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.895 0.379 . . . . 0.0 111.007 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -117.83 23.25 11.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.212 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.761 ' H ' HG22 ' A' ' 34' ' ' ILE . 17.2 m-20 -119.45 72.83 14.74 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.637 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.533 ' HA ' HD12 ' A' ' 40' ' ' LEU . 67.8 Cg_exo -36.37 -20.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.79 2.326 . . . . 0.0 112.036 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.632 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.3 OUTLIER -72.51 -53.76 11.15 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.728 -1.123 . . . . 0.0 111.387 -179.245 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.825 ' CZ ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.13 -28.41 64.27 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.609 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 8.5 mt -62.35 -51.97 65.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.581 ' CE1' HD22 ' A' ' 25' ' ' LEU . 24.9 m-70 -59.69 -33.98 72.27 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.721 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -56.32 -47.76 78.08 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.006 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -63.83 -54.24 38.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.732 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.902 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.3 mm? -46.89 -37.36 8.75 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.866 0.365 . . . . 0.0 110.325 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -80.79 -28.53 36.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.323 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.466 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -77.31 -21.62 53.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.118 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.504 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 59.7 p -101.02 17.78 21.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.77 0.319 . . . . 0.0 110.987 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.504 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.1 OUTLIER 48.89 32.16 3.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.151 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.08 -24.29 31.69 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.522 ' OD2' ' NE2' ' A' ' 53' ' ' GLN . 25.4 m-20 -65.57 99.7 0.45 Allowed 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.386 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.1 tt -57.58 -56.73 13.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.864 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.662 ' N ' HG23 ' A' ' 51' ' ' ILE . 55.4 m -43.55 -60.13 1.88 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.021 0.438 . . . . 0.0 110.071 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.563 ' O ' HD12 ' A' ' 57' ' ' LEU . 27.2 mt-30 -50.13 -57.98 6.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.635 179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.642 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -38.48 -58.39 1.03 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.978 ' O ' HG22 ' A' ' 59' ' ' THR . 11.0 t -42.69 -57.46 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.091 0 CA-C-N 115.29 -0.868 . . . . 0.0 108.722 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.456 ' N ' ' O ' ' A' ' 53' ' ' GLN . 6.8 t -48.47 -47.32 38.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.359 -1.291 . . . . 0.0 110.919 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.563 HD12 ' O ' ' A' ' 53' ' ' GLN . 4.2 mp -59.65 -36.34 76.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.092 0.472 . . . . 0.0 110.988 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.006 HD21 ' HB2' ' A' ' 43' ' ' ALA . 27.5 mt -81.18 -22.65 38.76 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.797 -178.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.978 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -114.7 8.43 16.19 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.19 -178.655 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.646 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 11.0 t0 -58.35 15.79 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.469 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.676 ' H ' ' C ' ' A' ' 59' ' ' THR . 2.0 tp10 97.43 58.48 0.0 OUTLIER 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.829 0.347 . . . . 0.0 111.034 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.465 HH11 ' HD3' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -133.47 -84.2 0.45 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.162 0.506 . . . . 0.0 110.693 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.578 ' O ' ' O ' ' A' ' 64' ' ' LYS . 35.6 t -51.21 -85.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.204 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.657 ' NZ ' ' OG1' ' A' ' 59' ' ' THR . 9.7 mtpp 17.59 -138.47 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.384 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.5 ' OE1' ' N ' ' A' ' 65' ' ' GLU . 2.1 mp0 -138.25 86.42 17.13 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.366 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.553 ' O ' ' O ' ' A' ' 67' ' ' SER . 72.7 Cg_endo -81.02 -103.22 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.939 2.426 . . . . 0.0 112.379 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.581 ' O ' ' C ' ' A' ' 68' ' ' GLN . 3.1 t 29.51 96.18 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.394 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.581 ' C ' ' O ' ' A' ' 67' ' ' SER . 0.7 OUTLIER -15.33 -75.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.415 -179.761 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.573 ' O ' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -113.22 -39.7 4.09 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.327 0.584 . . . . 0.0 110.994 -179.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.573 ' OG1' ' O ' ' A' ' 69' ' ' ASP . 0.0 OUTLIER 166.81 -177.77 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.9 m -132.39 131.78 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.316 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.38 75.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.124 0.487 . . . . 0.0 110.826 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.6 m -170.9 -65.51 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.568 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.61 150.46 1.22 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.14 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.567 ' O ' ' O ' ' A' ' 76' ' ' SER . 25.2 Cg_endo -66.14 165.55 23.89 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.562 2.175 . . . . 0.0 111.975 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.567 ' O ' ' O ' ' A' ' 75' ' ' PRO . 5.7 m -35.15 162.09 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.704 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -102.8 -78.1 0.55 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.229 0.538 . . . . 0.0 110.323 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.503 HG12 ' H ' ' A' ' 79' ' ' GLU . 2.0 t -67.01 -138.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.474 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.503 ' H ' HG12 ' A' ' 78' ' ' VAL . 12.9 mt-10 -113.37 -94.26 0.46 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.468 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.1 52.37 0.69 Allowed Glycine 0 CA--C 1.526 0.722 0 N-CA-C 111.042 -0.823 . . . . 0.0 111.042 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.0 m -140.49 170.71 15.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.901 0.382 . . . . 0.0 110.797 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.46 ' O ' ' HB2' ' A' ' 83' ' ' ALA . . . -84.68 176.82 8.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.801 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 82' ' ' ALA . . . 174.97 -171.61 0.06 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.444 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -103.7 24.59 10.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.492 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.32 173.17 9.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.604 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.598 ' O ' ' O ' ' A' ' 87' ' ' VAL . 3.6 tt0 67.48 97.32 0.06 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.716 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.598 ' O ' ' O ' ' A' ' 86' ' ' GLU . 2.9 m -25.5 151.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 115.267 -0.878 . . . . 0.0 111.569 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.16 -33.58 76.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.398 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.435 ' HB2' HG23 ' A' ' 87' ' ' VAL . . . 54.4 173.31 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.983 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.32 -151.41 0.47 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.862 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.565 ' O ' HG13 ' A' ' 91' ' ' VAL . 8.5 p -78.54 44.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.757 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.488 ' O ' HD13 ' A' ' 92' ' ' ILE . 0.1 OUTLIER -52.42 136.42 12.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.95 0.405 . . . . 0.0 110.813 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -154.68 91.63 1.4 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.281 0.562 . . . . 0.0 110.217 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.526 ' HG ' ' H ' ' A' ' 95' ' ' THR . 0.8 OUTLIER -165.37 -51.21 0.03 OUTLIER 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.364 -178.588 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.526 ' H ' ' HG ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -30.2 127.8 0.13 Allowed 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.532 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -105.83 179.67 4.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.726 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.512 ' OD1' ' N ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -116.71 156.2 27.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.712 -179.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.75 ' H ' ' ND2' ' A' ' 98' ' ' ASN . 0.0 OUTLIER -88.71 156.48 18.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.338 179.792 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER -94.09 -8.01 40.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.764 -179.845 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.491 ' O ' ' HB3' ' A' ' 104' ' ' ALA . 64.2 m-20 -44.29 -18.64 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 99' ' ' LYS . 0.3 OUTLIER -61.52 -58.79 6.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.952 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.877 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.6 pp -79.47 -34.65 41.28 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.212 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.877 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -62.57 -40.37 96.64 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.813 0.816 . . . . 0.0 109.392 -179.073 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 100' ' ' ASP . . . -79.2 -56.55 4.27 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.889 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -53.21 -44.67 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.17 0.509 . . . . 0.0 109.834 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.652 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.9 mm -64.63 -53.15 45.83 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.388 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.91 -50.15 73.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.94 0.4 . . . . 0.0 110.605 -178.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.405 ' HA ' HD13 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -55.89 -46.3 78.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.852 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.54 -16.93 53.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.98 0.419 . . . . 0.0 111.156 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.995 HD13 ' O ' ' A' ' 110' ' ' LEU . 3.3 tm? -89.91 -14.0 35.13 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.556 -179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -92.17 -18.99 22.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.323 179.354 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -84.17 -34.15 24.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.976 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' ' 114' ' ' PRO . 0.0 OUTLIER -52.07 -55.89 26.79 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.523 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 113' ' ' SER . 62.3 Cg_exo -43.27 152.27 0.26 Allowed 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.619 2.213 . . . . 0.0 111.805 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.447 ' H ' ' CD ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -101.26 -161.31 0.85 Allowed 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.25 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.92 HG22 ' H ' ' A' ' 117' ' ' GLN . 14.9 mt -128.6 -141.28 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.781 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.92 ' H ' HG22 ' A' ' 116' ' ' ILE . 0.2 OUTLIER -79.58 78.26 6.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.568 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -113.34 171.9 7.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.665 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -98.03 -57.31 2.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.566 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.756 0 CA-C-O 118.011 -1.439 . . . . 0.0 110.926 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmm . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.591 ' O ' ' O ' ' A' ' 3' ' ' ALA . 0.6 OUTLIER -119.26 94.97 4.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.564 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.591 ' O ' ' O ' ' A' ' 2' ' ' THR . . . -15.98 -106.39 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.366 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 4' ' ' GLU . 1.2 pt-20 -112.18 166.97 10.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.579 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.966 ' N ' HD22 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -96.85 -129.92 0.17 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.468 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.498 ' C ' ' H ' ' A' ' 8' ' ' ASP . 4.7 tt0 39.45 23.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.867 0.365 . . . . 0.0 110.314 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 5' ' ' LEU . 6.9 tt0 -57.53 -2.49 0.13 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.624 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.498 ' H ' ' C ' ' A' ' 6' ' ' GLN . 1.3 m-20 -92.13 -19.45 22.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.27 0.557 . . . . 0.0 110.379 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -39.24 -68.96 0.14 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.716 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.64 21.2 0.29 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.255 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 8' ' ' ASP . . . -106.55 -103.73 0.34 Allowed 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.411 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 92.92 111.68 2.04 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -109.77 -153.21 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.8 0.333 . . . . 0.0 110.396 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -131.24 -1.52 4.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.471 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -83.64 151.45 25.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.54 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 167.03 124.22 0.7 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -117.01 159.21 22.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.805 0.336 . . . . 0.0 110.722 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -176.42 50.05 0.11 Allowed Glycine 0 CA--C 1.525 0.656 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.3 m -133.44 -152.33 0.48 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.78 0.324 . . . . 0.0 110.563 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.98 105.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.465 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.64 ' O ' ' N ' ' A' ' 23' ' ' MET . 0.0 OUTLIER -81.69 162.73 22.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.461 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -41.73 -14.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.334 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.64 ' N ' ' O ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -61.75 -53.73 52.1 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.101 0.476 . . . . 0.0 110.72 -179.798 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.815 HD13 HD12 ' A' ' 51' ' ' ILE . 3.0 mm? -52.42 -62.75 1.44 Allowed 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.683 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.017 HD22 ' H ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -54.51 -43.83 72.2 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.882 -178.567 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.545 ' O ' ' CB ' ' A' ' 30' ' ' GLU . 0.7 OUTLIER -69.43 -42.86 74.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.313 -178.333 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.766 ' O ' HG22 ' A' ' 31' ' ' ILE . 3.9 mm-40 -61.29 -52.83 63.05 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.267 -178.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.84 HD23 ' H ' ' A' ' 29' ' ' ARG . 1.4 pt? -70.68 -48.6 53.91 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.519 -178.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.84 ' H ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -66.5 -26.6 67.24 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.526 -179.224 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.545 ' CB ' ' O ' ' A' ' 26' ' ' ASN . 29.5 tp10 -87.87 -57.5 2.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.22 0.533 . . . . 0.0 110.47 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.766 HG22 ' O ' ' A' ' 27' ' ' GLN . 16.4 tt -54.43 -35.46 31.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.672 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.523 HG23 HG23 ' A' ' 31' ' ' ILE . 46.8 p -92.25 -31.28 15.47 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.722 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 70.25 36.31 70.68 Favored Glycine 0 N--CA 1.462 0.394 0 N-CA-C 109.103 -1.599 . . . . 0.0 109.103 -179.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.998 HG22 ' H ' ' A' ' 36' ' ' ASP . 3.8 mm -92.5 152.92 3.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.583 -0.808 . . . . 0.0 112.633 -177.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -122.93 18.75 10.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.483 178.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.998 ' H ' HG22 ' A' ' 34' ' ' ILE . 1.4 m-20 -119.54 65.56 8.92 Favored Pre-proline 0 N--CA 1.455 -0.19 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.264 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.61 ' HA ' HD12 ' A' ' 40' ' ' LEU . 70.6 Cg_exo -35.81 -20.33 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.851 0 C-N-CA 122.973 2.448 . . . . 0.0 111.971 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.666 ' N ' ' O ' ' A' ' 36' ' ' ASP . 25.2 t -75.33 -52.68 10.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.787 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.727 ' CE1' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.1 -24.15 62.24 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.617 HD22 ' HG ' ' A' ' 28' ' ' LEU . 24.0 mt -66.41 -59.9 3.25 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.337 -1.302 . . . . 0.0 108.917 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.653 ' C ' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -53.89 -40.31 66.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.603 179.51 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -49.88 -48.73 51.23 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.929 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -61.67 -59.94 4.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.498 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.465 ' N ' ' CD2' ' A' ' 44' ' ' LEU . 2.2 mm? -45.27 -24.24 0.26 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.887 0.375 . . . . 0.0 110.017 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.484 ' HD3' ' ND1' ' A' ' 41' ' ' HIS . 0.6 OUTLIER -82.64 -42.24 18.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.792 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -76.6 -24.29 53.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.474 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 84.1 p -84.92 -2.95 58.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.344 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.7 m120 60.73 26.84 16.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.101 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.97 -24.03 31.85 Favored Glycine 0 CA--C 1.528 0.894 0 C-N-CA 121.027 -0.606 . . . . 0.0 111.75 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.16 102.62 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.697 -0.401 . . . . 0.0 109.947 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.815 HD12 HD13 ' A' ' 24' ' ' LEU . 0.8 OUTLIER -58.77 -57.41 11.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.873 -179.052 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.647 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 25.8 m -41.2 -61.28 1.04 Allowed 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.197 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.609 ' O ' HD12 ' A' ' 57' ' ' LEU . 31.9 mt-30 -50.58 -55.99 13.78 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.618 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 53' ' ' GLN . . . -41.21 -54.03 3.02 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.951 ' O ' HG22 ' A' ' 59' ' ' THR . 23.4 t -45.57 -59.51 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.221 178.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.1 t -45.38 -49.24 13.24 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.101 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.609 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.5 mp -63.54 -27.62 69.38 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.811 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.929 HD21 ' HB2' ' A' ' 43' ' ' ALA . 89.4 mt -91.49 -9.48 44.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.704 -178.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.6 OUTLIER -131.77 6.71 4.36 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.906 -0.717 . . . . 0.0 112.41 -179.116 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.457 ' HB3' ' CZ ' ' A' ' 62' ' ' ARG . 28.8 t0 -67.14 24.09 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.736 179.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.692 ' H ' ' C ' ' A' ' 59' ' ' THR . 3.5 tm-20 78.35 63.27 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.69 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.752 ' C ' ' H ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -121.97 -110.55 0.33 Allowed 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.476 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.554 HG12 ' O ' ' A' ' 63' ' ' VAL . 97.4 t 48.94 -5.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.519 179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.752 ' H ' ' C ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -148.02 -139.39 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.474 -179.76 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.494 ' N ' ' CG ' ' A' ' 64' ' ' LYS . 2.5 mm-40 -130.13 78.35 74.84 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.278 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.42 ' O ' ' O ' ' A' ' 65' ' ' GLU . 39.3 Cg_exo -56.51 -142.25 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.813 2.342 . . . . 0.0 112.159 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.561 ' OG ' ' N ' ' A' ' 68' ' ' GLN . 0.2 OUTLIER -145.22 -163.8 1.8 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.567 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.689 ' CD ' ' H ' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -62.62 -14.87 48.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 -179.958 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.73 -19.02 5.39 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.178 0.513 . . . . 0.0 110.57 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.2 p -96.8 -118.53 0.12 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.468 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 73' ' ' THR . 1.0 OUTLIER -68.99 134.3 30.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.499 179.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -52.51 -32.55 40.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.396 0.617 . . . . 0.0 110.133 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 1.047 HG22 ' H ' ' A' ' 74' ' ' GLU . 4.2 m -87.51 -166.21 1.52 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.942 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 1.047 ' H ' HG22 ' A' ' 73' ' ' THR . 6.8 tt0 48.2 81.02 0.27 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.78 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.452 ' O ' ' O ' ' A' ' 74' ' ' GLU . 50.6 Cg_exo -48.79 -172.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.754 2.303 . . . . 0.0 111.943 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.448 ' OG ' ' N ' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -144.18 -174.53 4.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.887 0.375 . . . . 0.0 110.615 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.448 ' N ' ' OG ' ' A' ' 76' ' ' SER . 41.8 mt-10 -78.54 -76.11 0.21 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.543 0.687 . . . . 0.0 110.594 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 1.014 HG22 ' H ' ' A' ' 79' ' ' GLU . 6.5 p -111.75 -146.53 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.339 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 1.014 ' H ' HG22 ' A' ' 78' ' ' VAL . 83.6 mt-10 -132.11 163.34 28.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.647 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 70.5 102.88 0.04 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.53 -174.16 2.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.683 0.277 . . . . 0.0 110.359 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -43.34 164.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.463 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.473 ' O ' ' C ' ' A' ' 84' ' ' ASN . . . -93.05 -35.12 13.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.298 0.57 . . . . 0.0 110.375 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.473 ' C ' ' O ' ' A' ' 83' ' ' ALA . 1.4 m-80 32.75 76.38 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.667 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -123.65 -176.23 3.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.229 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.92 -9.35 44.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.701 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.8 t -147.04 121.39 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.006 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 88' ' ' LEU . 5.4 mp -87.01 -26.6 23.68 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.511 0.672 . . . . 0.0 109.298 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.403 ' O ' ' HE3' ' A' ' 90' ' ' LYS . . . 48.85 92.24 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.665 -1.152 . . . . 0.0 111.005 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.654 ' O ' ' N ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -120.66 -164.06 1.07 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.615 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.643 ' O ' HG12 ' A' ' 91' ' ' VAL . 22.0 t 40.52 13.32 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.418 179.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.654 ' N ' ' O ' ' A' ' 90' ' ' LYS . 2.6 pt -40.55 128.44 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.336 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.684 ' C ' HD12 ' A' ' 94' ' ' LEU . 0.8 OUTLIER -170.29 116.53 0.52 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.95 0.405 . . . . 0.0 110.673 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.684 HD12 ' C ' ' A' ' 93' ' ' ASP . 3.7 mp -154.81 -88.83 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.124 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.975 HG23 ' H ' ' A' ' 96' ' ' HIS . 1.3 t -126.3 -91.17 0.53 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.443 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.975 ' H ' HG23 ' A' ' 95' ' ' THR . 1.7 p80 -104.11 -126.74 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.304 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.553 ' C ' ' O ' ' A' ' 96' ' ' HIS . 1.5 t0 26.22 45.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.765 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.5 ' CG ' ' H ' ' A' ' 99' ' ' LYS . 0.7 OUTLIER -86.91 -131.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.713 -179.86 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.5 ' H ' ' CG ' ' A' ' 98' ' ' ASN . 3.5 pttp -84.25 -96.79 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.159 0.504 . . . . 0.0 110.703 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.462 ' O ' ' CB ' ' A' ' 104' ' ' ALA . 41.4 m-20 -43.83 -20.82 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.521 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' A' ' 99' ' ' LYS . 2.9 t0 -63.07 -58.35 7.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.872 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.063 HD12 ' N ' ' A' ' 103' ' ' GLN . 3.9 pp -78.85 -32.71 46.16 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.085 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 1.063 ' N ' HD12 ' A' ' 102' ' ' LEU . 2.1 tt0 -65.3 -38.86 91.51 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.761 0.791 . . . . 0.0 109.733 -178.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.462 ' CB ' ' O ' ' A' ' 100' ' ' ASP . . . -78.79 -49.92 12.19 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.93 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.01 94.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.435 0.636 . . . . 0.0 109.399 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.666 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.6 mm -63.46 -43.43 98.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.975 179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.43 ' O ' HD23 ' A' ' 111' ' ' LEU . . . -68.64 -40.83 80.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.186 -178.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.92 -35.01 79.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.58 -20.71 20.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.183 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.573 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -83.8 -27.83 28.53 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.57 0.7 . . . . 0.0 109.143 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.555 ' O ' ' C ' ' A' ' 112' ' ' GLU . 0.4 OUTLIER -56.61 -85.93 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.823 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.555 ' C ' ' O ' ' A' ' 111' ' ' LEU . 0.0 OUTLIER -21.04 -59.75 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.849 -179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 110' ' ' LEU . 1.2 t -76.89 113.12 27.18 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.21 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -77.99 -109.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.332 2.021 . . . . 0.0 112.194 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -139.98 -178.95 5.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.753 0.311 . . . . 0.0 110.528 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 1.104 HG23 ' H ' ' A' ' 117' ' ' GLN . 8.6 tt -75.41 -101.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.827 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 1.104 ' H ' HG23 ' A' ' 116' ' ' ILE . 3.2 pt20 -68.39 61.76 0.09 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.732 0.301 . . . . 0.0 110.845 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.583 ' O ' ' O ' ' A' ' 117' ' ' GLN . . . -49.53 -114.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.701 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -125.84 -38.87 2.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.67 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.747 0 CA-C-O 117.922 -1.488 . . . . 0.0 111.087 -179.821 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.508 ' CG ' ' N ' ' A' ' 2' ' ' THR . 1.5 ptp . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.508 ' N ' ' CG ' ' A' ' 1' ' ' MET . 33.0 m -97.73 -51.82 3.96 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.619 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.44 ' C ' ' O ' ' A' ' 2' ' ' THR . . . 36.4 -142.34 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.422 ' O ' ' C ' ' A' ' 5' ' ' LEU . 1.5 tp10 54.1 -162.77 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.777 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' GLU . 1.2 mt 38.12 -142.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.524 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 5' ' ' LEU . 36.8 tt0 37.61 86.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.748 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -70.3 -3.46 17.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.683 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.86 -20.49 42.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.108 0.48 . . . . 0.0 110.49 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.567 ' O ' ' O ' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -72.94 -18.41 61.39 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.355 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.567 ' O ' ' O ' ' A' ' 9' ' ' ASP . . . 39.11 102.81 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.685 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -128.32 34.82 4.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.663 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -106.3 -53.61 0.73 Allowed Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 14' ' ' ALA . . . -97.29 -172.64 2.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.81 0.338 . . . . 0.0 110.593 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 13' ' ' ALA . . . 38.77 -165.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.548 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -155.25 179.15 9.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.496 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 149.02 -70.66 0.32 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.611 ' O ' ' CG ' ' A' ' 17' ' ' HIS . 0.2 OUTLIER -42.11 103.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.797 0.332 . . . . 0.0 110.482 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 169.75 81.18 0.05 OUTLIER Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.497 ' O ' ' OG ' ' A' ' 19' ' ' SER . 4.3 p -131.64 53.97 1.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.879 0.371 . . . . 0.0 110.619 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m 53.63 -175.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.679 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.2 m -123.86 104.83 9.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.497 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.425 ' HG3' ' CE ' ' A' ' 23' ' ' MET . 3.3 pt20 -73.06 -12.5 60.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.838 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.425 ' CE ' ' HG3' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -58.68 -31.31 68.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.128 0.489 . . . . 0.0 110.687 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.417 ' O ' HD11 ' A' ' 51' ' ' ILE . 6.0 mp -62.1 -62.64 1.63 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.083 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.505 ' CD2' ' H ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -64.81 -44.7 89.06 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.9 -179.584 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -56.52 -59.48 4.92 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.243 0.544 . . . . 0.0 110.865 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -52.4 -50.2 62.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.607 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.796 HD13 ' HB3' ' A' ' 40' ' ' LEU . 5.1 mt -44.76 -59.32 2.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.362 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -69.32 -20.49 63.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.095 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -80.97 -21.36 40.39 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.788 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.498 HG21 HG11 ' A' ' 55' ' ' VAL . 30.8 mt -98.5 -50.76 10.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.387 0.613 . . . . 0.0 111.491 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.461 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -85.6 -37.21 19.8 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.944 -1.025 . . . . 0.0 111.492 -178.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 76.95 36.11 37.1 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.85 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.3 mm -97.15 154.8 3.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.973 0.416 . . . . 0.0 111.203 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -121.65 23.5 10.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.044 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.85 ' H ' HG22 ' A' ' 34' ' ' ILE . 2.4 t70 -121.98 73.73 36.36 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.366 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.574 ' HA ' HD12 ' A' ' 40' ' ' LEU . 56.2 Cg_exo -36.99 -21.14 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.954 2.436 . . . . 0.0 112.37 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.595 ' N ' ' O ' ' A' ' 36' ' ' ASP . 9.3 m -68.57 -54.27 17.68 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.841 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.853 ' CE2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -75.5 -26.57 58.25 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.796 ' HB3' HD13 ' A' ' 28' ' ' LEU . 10.6 mt -61.31 -60.29 3.97 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.475 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -52.6 -50.75 62.43 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.754 179.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.442 ' C ' ' O ' ' A' ' 41' ' ' HIS . 25.1 tt0 -40.33 -47.28 2.49 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 54' ' ' ALA . . . -60.4 -49.63 76.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.066 178.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.769 ' CD2' HD11 ' A' ' 28' ' ' LEU . 1.0 OUTLIER -58.01 -25.22 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.437 179.671 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 41' ' ' HIS . 11.3 mmmt -79.07 -38.98 35.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.94 0.4 . . . . 0.0 110.433 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -79.6 -26.62 41.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.106 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.487 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 1.9 p -88.32 10.36 20.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.262 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 47' ' ' SER . 0.0 OUTLIER 49.88 30.78 4.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.723 0.297 . . . . 0.0 110.888 179.624 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.51 -23.42 35.15 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.437 ' O ' ' OG ' ' A' ' 47' ' ' SER . 29.6 t0 -63.03 96.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.029 0.442 . . . . 0.0 110.172 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.62 ' CG2' ' N ' ' A' ' 52' ' ' THR . 1.0 OUTLIER -56.35 -52.73 48.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.572 -178.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.62 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 23.4 m -50.82 -46.11 59.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.052 0.453 . . . . 0.0 110.929 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.605 ' O ' HD12 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -65.86 -53.56 38.2 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.653 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.731 ' HB1' ' HB1' ' A' ' 43' ' ' ALA . . . -41.45 -54.56 3.07 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.824 ' O ' HG22 ' A' ' 59' ' ' THR . 42.6 t -46.62 -57.17 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.757 177.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.55 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 1.4 t -49.39 -45.97 46.73 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.993 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.9 mp -64.87 -27.89 69.17 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.853 HD22 ' CE2' ' A' ' 39' ' ' PHE . 79.8 mt -86.16 -23.95 26.36 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.635 -0.712 . . . . 0.0 112.899 -178.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.824 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.0 OUTLIER -125.52 14.5 8.19 Favored 'General case' 0 C--N 1.312 -1.048 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.104 -178.133 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.55 ' OD2' ' O ' ' A' ' 56' ' ' SER . 2.1 m-20 -73.36 24.61 0.07 Allowed 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 179.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.567 ' H ' ' C ' ' A' ' 59' ' ' THR . 2.8 tp10 74.11 66.66 0.09 Allowed 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.461 ' HD3' ' N ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER -132.98 -53.14 0.91 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.466 -177.658 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.597 ' O ' ' O ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -43.2 -84.43 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.997 -178.596 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.597 ' O ' ' O ' ' A' ' 63' ' ' VAL . 0.1 OUTLIER 28.93 -155.04 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.621 -179.763 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -143.37 78.1 15.06 Favored Pre-proline 0 CA--C 1.529 0.162 0 CA-C-O 121.088 0.471 . . . . 0.0 110.586 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.585 ' O ' ' O ' ' A' ' 67' ' ' SER . 69.5 Cg_endo -86.23 -158.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 123.202 2.601 . . . . 0.0 112.225 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 66' ' ' PRO . 0.1 OUTLIER 42.42 -178.21 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.833 179.786 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.472 ' CG ' ' N ' ' A' ' 69' ' ' ASP . 0.3 OUTLIER -138.87 -117.4 0.14 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.502 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.472 ' N ' ' CG ' ' A' ' 68' ' ' GLN . 6.9 m-20 -104.56 -19.13 14.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.294 0.569 . . . . 0.0 110.175 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.595 ' O ' HG13 ' A' ' 71' ' ' VAL . 0.0 OUTLIER -162.64 -164.24 0.99 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.338 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.595 HG13 ' O ' ' A' ' 70' ' ' THR . 2.6 m -158.69 139.2 4.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.444 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.538 ' C ' ' OG1' ' A' ' 73' ' ' THR . . . -82.39 -36.76 26.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.186 0.517 . . . . 0.0 110.541 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.538 ' OG1' ' C ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER 171.38 -85.85 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.996 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.764 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.1 OUTLIER -109.02 -15.44 0.13 Allowed Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.764 ' CD ' ' N ' ' A' ' 74' ' ' GLU . 72.7 Cg_endo -79.74 -107.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.312 -1.347 0 C-N-CA 121.919 1.746 . . . . 0.0 112.48 -179.272 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.563 ' O ' ' C ' ' A' ' 77' ' ' GLU . 0.4 OUTLIER 36.04 -86.37 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.039 0.447 . . . . 0.0 110.822 179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.657 ' N ' ' O ' ' A' ' 75' ' ' PRO . 13.8 mp0 -21.64 -59.64 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.16 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.935 HG12 ' H ' ' A' ' 79' ' ' GLU . 6.5 t -77.61 -141.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.647 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.935 ' H ' HG12 ' A' ' 78' ' ' VAL . 63.2 mt-10 -144.55 -104.47 0.11 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.686 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -136.8 -143.4 4.6 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.1 m -142.36 176.19 9.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.769 0.319 . . . . 0.0 110.636 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -44.3 118.84 1.63 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.778 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 46.59 -151.45 0.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.627 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 -125.28 18.99 8.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.2 166.8 9.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.43 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 178.51 -26.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.652 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -111.09 153.09 12.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.803 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.448 ' O ' ' HB3' ' A' ' 89' ' ' ALA . 3.6 mm? -63.72 -33.48 75.74 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.685 0.755 . . . . 0.0 110.063 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 88' ' ' LEU . . . 67.26 -179.63 0.22 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 114.425 -1.261 . . . . 0.0 110.619 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.566 ' O ' ' C ' ' A' ' 91' ' ' VAL . 0.0 OUTLIER -125.49 -84.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.001 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.773 ' O ' HG22 ' A' ' 91' ' ' VAL . 7.1 p 19.4 53.98 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.112 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.811 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.554 ' O ' ' OD2' ' A' ' 93' ' ' ASP . 10.4 mt 62.61 -122.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.718 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.566 ' O ' ' CG ' ' A' ' 93' ' ' ASP . 0.0 OUTLIER 85.54 104.8 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 121.383 0.611 . . . . 0.0 109.377 -179.415 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.438 ' C ' ' H ' ' A' ' 96' ' ' HIS . 1.3 mt -133.14 -68.23 0.59 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.022 -178.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.458 ' O ' ' OG1' ' A' ' 95' ' ' THR . 0.4 OUTLIER -73.0 13.93 0.34 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.002 -179.637 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.557 ' CE1' ' OD1' ' A' ' 93' ' ' ASP . 0.4 OUTLIER -74.61 154.92 38.33 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.844 0.354 . . . . 0.0 110.689 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.91 108.76 21.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.785 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 177.07 -19.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.448 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -74.36 -78.51 0.1 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.52 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -52.23 -17.58 1.18 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.336 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -61.9 -58.7 6.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.494 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.02 HD12 ' N ' ' A' ' 103' ' ' GLN . 3.6 pp -76.74 -31.12 56.91 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.61 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 1.02 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -64.1 -39.72 94.67 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.783 0.801 . . . . 0.0 109.486 -178.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.55 -56.39 4.75 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.209 -1.36 . . . . 0.0 110.438 179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.11 -54.47 39.14 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.661 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.4 mm -50.46 -65.84 0.23 Allowed 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.317 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -46.02 -45.02 15.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.55 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.23 -28.68 69.33 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.666 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.59 -16.65 18.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.043 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.678 HD13 ' O ' ' A' ' 110' ' ' LEU . 0.2 OUTLIER -97.94 -10.47 24.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.552 0.691 . . . . 0.0 109.659 -179.395 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.642 ' C ' ' H ' ' A' ' 113' ' ' SER . 20.7 mt -128.63 -158.75 0.9 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.254 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.452 ' N ' ' HD2' ' A' ' 114' ' ' PRO . 6.2 tm-20 67.93 -27.69 0.14 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.202 0.525 . . . . 0.0 110.575 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.755 ' N ' ' CD ' ' A' ' 114' ' ' PRO . 0.2 OUTLIER -86.17 -32.91 0.45 Allowed Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.545 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.755 ' CD ' ' N ' ' A' ' 113' ' ' SER . 20.9 Cg_endo -82.11 -151.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.731 2.288 . . . . 0.0 111.923 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.7 tptt -115.29 -176.77 2.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.836 0.351 . . . . 0.0 110.834 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 7.0 mt -110.14 -9.83 11.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.371 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.93 101.02 13.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.766 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 44.42 -143.87 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.859 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -81.9 -42.07 20.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.566 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.75 0 CA-C-O 117.955 -1.469 . . . . 0.0 110.916 -179.952 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.447 ' O ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.477 ' O ' ' O ' ' A' ' 3' ' ' ALA . 12.6 t -66.35 145.33 55.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.611 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' A' ' 2' ' ' THR . . . -50.7 -172.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.546 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.763 ' C ' HD13 ' A' ' 5' ' ' LEU . 9.4 mp0 -62.58 163.04 9.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.445 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.031 ' H ' HD22 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -116.93 171.29 8.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.657 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.598 ' C ' ' H ' ' A' ' 8' ' ' ASP . 4.5 mm100 -67.61 -64.98 0.75 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.336 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 55.28 -2.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.942 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.598 ' H ' ' C ' ' A' ' 6' ' ' GLN . 2.4 m-20 -109.7 -25.48 10.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.179 0.514 . . . . 0.0 110.759 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -57.02 -28.98 62.98 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.04 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.13 165.98 28.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.632 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -155.6 -25.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.627 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 118.01 -162.49 13.1 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.475 ' O ' ' C ' ' A' ' 14' ' ' ALA . . . -78.78 -156.44 0.1 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.72 0.295 . . . . 0.0 110.648 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.475 ' C ' ' O ' ' A' ' 13' ' ' ALA . . . 33.33 -137.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.556 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -70.12 -168.88 0.24 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.619 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 126.78 108.38 1.55 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.959 -0.857 . . . . 0.0 110.959 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -116.35 174.64 5.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.8 0.333 . . . . 0.0 110.721 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -128.89 119.11 2.9 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 20' ' ' SER . 53.7 p -104.32 -111.06 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.813 0.34 . . . . 0.0 110.636 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 19' ' ' SER . 0.3 OUTLIER 75.42 -6.0 2.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.423 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.52 ' HB2' HD11 ' A' ' 24' ' ' LEU . 90.2 m -97.18 128.73 44.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.217 179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -81.61 -28.13 33.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.892 -179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -23.17 49.23 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.95 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 21' ' ' CYS . 4.6 mt -69.13 -63.35 1.08 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.276 0.56 . . . . 0.0 110.926 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -33.61 76.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.439 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.48 -56.99 12.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.077 0.465 . . . . 0.0 110.195 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 30' ' ' GLU . 24.3 mm-40 -55.78 -59.87 4.26 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.509 -0.768 . . . . 0.0 109.996 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.918 HD22 ' CD2' ' A' ' 44' ' ' LEU . 10.3 tp -46.6 -51.66 15.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.8 179.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.2 ttt180 -63.78 -21.4 66.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.595 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 27' ' ' GLN . 2.8 tt0 -84.63 -21.91 30.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.579 -179.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.539 HG21 HG11 ' A' ' 55' ' ' VAL . 44.3 mt -94.35 -50.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.493 0.663 . . . . 0.0 111.311 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.517 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.5 p -85.52 -37.83 19.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.397 -178.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.36 36.32 17.67 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.654 HG21 ' CD1' ' A' ' 39' ' ' PHE . 1.1 mm -97.57 143.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.736 0.303 . . . . 0.0 110.351 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -114.89 23.38 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.863 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.645 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -113.83 73.19 2.21 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.338 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -35.11 -24.21 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.938 2.425 . . . . 0.0 112.503 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.586 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.2 OUTLIER -71.4 -52.31 19.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.797 179.783 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 1.107 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -71.19 -28.38 64.18 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.772 HD23 HD23 ' A' ' 28' ' ' LEU . 1.2 mp -70.3 -48.35 57.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -62.18 -27.25 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.228 178.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -65.19 -48.38 73.64 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.885 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -62.2 -47.46 84.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.918 ' CD2' HD22 ' A' ' 28' ' ' LEU . 4.1 mm? -55.64 -42.58 75.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.189 -179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.453 ' HD3' ' N ' ' A' ' 46' ' ' ALA . 5.0 tmtt? -74.44 -27.19 60.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.763 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.453 ' N ' ' HD3' ' A' ' 45' ' ' LYS . . . -79.2 -24.15 43.35 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.084 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.469 ' OG ' ' N ' ' A' ' 54' ' ' ALA . 0.4 OUTLIER -96.2 17.01 16.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.162 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 61.95 22.13 12.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.195 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.78 -23.53 33.55 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -62.96 124.03 20.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.738 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.1 tt -74.72 -55.49 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.077 -179.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.632 ' N ' ' CG2' ' A' ' 51' ' ' ILE . 22.0 m -43.46 -54.19 4.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 0.0 110.169 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.589 ' O ' HD12 ' A' ' 57' ' ' LEU . 25.6 mt-30 -57.73 -54.52 45.94 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.469 ' N ' ' OG ' ' A' ' 47' ' ' SER . . . -40.37 -51.18 2.83 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.738 HG23 ' O ' ' A' ' 51' ' ' ILE . 18.1 t -50.38 -61.19 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.024 178.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.0 t -41.94 -48.31 4.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.286 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.589 HD12 ' O ' ' A' ' 53' ' ' GLN . 6.6 mp -63.09 -29.82 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.934 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.107 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 37.7 mt -89.93 -11.19 42.46 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -177.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.717 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.4 OUTLIER -117.79 -10.27 10.53 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.87 -0.732 . . . . 0.0 111.832 -179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -61.24 -56.16 23.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.315 0.578 . . . . 0.0 110.542 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.474 ' CD ' ' C ' ' A' ' 61' ' ' GLU . 0.4 OUTLIER 178.82 92.21 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.598 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.851 HH11 ' H ' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -125.16 -94.11 0.48 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.187 0.518 . . . . 0.0 112.218 -178.6 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.531 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -87.46 -22.22 6.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.829 -178.296 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.851 ' H ' HH11 ' A' ' 62' ' ' ARG . 0.0 OUTLIER -51.83 146.85 7.56 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.477 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.522 ' O ' ' O ' ' A' ' 66' ' ' PRO . 2.1 mt-10 -105.0 102.08 33.71 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.797 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.522 ' O ' ' O ' ' A' ' 65' ' ' GLU . 50.7 Cg_exo -52.2 -131.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.637 2.224 . . . . 0.0 112.194 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 68' ' ' GLN . 43.5 t -179.58 -27.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.876 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.462 ' O ' ' O ' ' A' ' 67' ' ' SER . 3.5 mm100 -51.78 -108.4 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.826 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.17 -17.31 35.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.211 0.529 . . . . 0.0 110.721 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.7 p -100.76 135.99 41.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.69 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.753 HG12 ' N ' ' A' ' 72' ' ' ALA . 39.1 t -141.19 173.98 8.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.771 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.753 ' N ' HG12 ' A' ' 71' ' ' VAL . . . -115.3 -90.73 0.54 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.067 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.4 m -153.07 -68.8 0.15 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.38 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.734 ' H ' ' CD ' ' A' ' 75' ' ' PRO . 0.8 OUTLIER -110.43 -40.53 0.11 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.7 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.734 ' CD ' ' H ' ' A' ' 74' ' ' GLU . 28.3 Cg_exo -58.38 -172.37 0.05 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.613 2.208 . . . . 0.0 111.939 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.95 -154.38 0.05 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.581 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -47.29 -82.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.19 0.519 . . . . 0.0 110.366 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 79' ' ' GLU . 2.9 t -114.95 -129.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.479 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.47 ' H ' HG12 ' A' ' 78' ' ' VAL . 5.2 mt-10 -123.23 -105.51 0.36 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.583 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -119.18 -96.57 1.7 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 m -120.6 -168.99 1.73 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.86 0.362 . . . . 0.0 110.667 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -42.66 -85.66 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.793 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -95.79 160.21 14.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.457 ' O ' ' O ' ' A' ' 85' ' ' LYS . 0.7 OUTLIER -155.34 16.16 0.4 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.224 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.457 ' O ' ' O ' ' A' ' 84' ' ' ASN . 0.1 OUTLIER -58.56 -131.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.956 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.438 ' H ' ' CG ' ' A' ' 85' ' ' LYS . 53.4 tt0 -86.09 -17.27 35.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.633 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.571 HG12 ' H ' ' A' ' 89' ' ' ALA . 4.1 t -127.96 140.11 50.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.526 ' H ' HD12 ' A' ' 88' ' ' LEU . 5.0 mp -78.46 -27.77 46.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.135 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.571 ' H ' HG12 ' A' ' 87' ' ' VAL . . . 51.3 178.87 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.421 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.409 ' C ' ' H ' ' A' ' 92' ' ' ILE . 0.2 OUTLIER -138.53 -143.69 0.17 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.916 -179.695 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.569 ' O ' ' C ' ' A' ' 92' ' ' ILE . 2.5 t -73.21 45.86 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.371 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.569 ' C ' ' O ' ' A' ' 91' ' ' VAL . 17.7 pt -19.41 128.43 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.162 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -175.55 110.77 0.11 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.552 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.585 ' CG ' ' H ' ' A' ' 95' ' ' THR . 0.2 OUTLIER -131.2 -80.19 0.53 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.988 -179.158 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.737 ' OG1' ' N ' ' A' ' 96' ' ' HIS . 0.3 OUTLIER 40.22 -160.76 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.136 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.737 ' N ' ' OG1' ' A' ' 95' ' ' THR . 52.6 m80 62.8 164.1 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.713 0.292 . . . . 0.0 110.516 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -113.84 126.85 55.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.15 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.579 ' C ' ' H ' ' A' ' 100' ' ' ASP . 2.4 t-20 61.35 177.38 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.332 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.443 ' C ' ' N ' ' A' ' 101' ' ' ASP . 0.0 OUTLIER 48.48 6.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.081 179.516 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.579 ' H ' ' C ' ' A' ' 98' ' ' ASN . 42.2 m-20 -50.45 -14.69 0.19 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.889 0.376 . . . . 0.0 110.426 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.443 ' N ' ' C ' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -65.12 -62.99 1.22 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.785 -178.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 1.044 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -82.19 -17.24 46.88 Favored 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 119.313 -0.955 . . . . 0.0 109.717 179.312 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.886 ' N ' HD22 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -71.46 -37.16 71.38 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.84 -49.49 20.41 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.159 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.46 76.45 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.713 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 3.5 mm -53.96 -48.17 63.86 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.986 179.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.12 -34.49 73.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.049 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 tp -69.64 -22.7 63.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.561 ' O ' ' O ' ' A' ' 113' ' ' SER . 0.6 OUTLIER -107.11 -18.93 13.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.56 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 28.5 tp -92.39 -27.06 17.75 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.206 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.37 -24.85 17.21 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.162 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -98.0 -20.2 17.55 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.816 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.58 ' O ' ' O ' ' A' ' 114' ' ' PRO . 0.3 OUTLIER -161.06 171.26 7.22 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.61 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.58 ' O ' ' O ' ' A' ' 113' ' ' SER . 50.6 Cg_exo -49.03 -157.66 0.0 OUTLIER 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.613 2.208 . . . . 0.0 112.019 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.418 ' H ' ' HG2' ' A' ' 115' ' ' LYS . 2.4 ptmt -101.06 -120.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.405 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.566 ' O ' ' N ' ' A' ' 118' ' ' ALA . 0.0 OUTLIER -120.25 155.26 23.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.308 179.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.563 ' C ' ' O ' ' A' ' 116' ' ' ILE . 0.0 OUTLIER -21.7 88.25 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.803 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 116' ' ' ILE . . . 40.03 -132.64 0.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.529 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.14 -24.22 5.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.336 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.765 0 CA-C-O 118.014 -1.437 . . . . 0.0 110.832 179.989 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 tpp . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.863 HG23 ' O ' ' A' ' 2' ' ' THR . 13.3 t -71.23 79.73 0.71 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.675 -179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.545 ' C ' ' O ' ' A' ' 2' ' ' THR . . . 29.72 -94.48 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.93 0.395 . . . . 0.0 109.987 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.639 ' O ' HG23 ' A' ' 2' ' ' THR . 13.2 pm0 -102.06 -138.23 0.34 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.173 179.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.692 ' N ' ' CD2' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -178.34 -168.09 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.854 -179.711 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.631 ' O ' ' N ' ' A' ' 8' ' ' ASP . 2.1 tt0 -160.82 31.03 0.15 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.818 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.58 -11.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.939 0.399 . . . . 0.0 110.612 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.631 ' N ' ' O ' ' A' ' 6' ' ' GLN . 0.3 OUTLIER -65.98 -18.9 65.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.289 179.771 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.608 ' CG ' ' H ' ' A' ' 10' ' ' ALA . 5.0 p-10 -50.97 -65.38 0.57 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.019 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.608 ' H ' ' CG ' ' A' ' 9' ' ' ASP . . . -89.63 -170.34 2.8 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.951 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -152.0 -52.49 0.12 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.518 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.533 ' O ' ' C ' ' A' ' 13' ' ' ALA . . . 76.66 106.0 0.14 Allowed Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.564 ' O ' ' C ' ' A' ' 14' ' ' ALA . . . 26.31 -109.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.823 0.344 . . . . 0.0 110.906 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.564 ' C ' ' O ' ' A' ' 13' ' ' ALA . . . -23.4 131.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.856 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -178.29 0.33 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.493 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -52.61 172.97 0.33 Allowed Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.102 -0.799 . . . . 0.0 111.102 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -163.09 54.79 0.19 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.833 0.349 . . . . 0.0 110.366 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -154.05 99.38 0.19 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.811 -0.916 . . . . 0.0 110.811 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 94.9 p -106.94 -27.32 10.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.737 0.303 . . . . 0.0 110.661 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.508 ' OG ' ' N ' ' A' ' 21' ' ' CYS . 0.9 OUTLIER 60.88 -160.28 0.3 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.45 -179.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.632 ' O ' ' CD2' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -74.91 111.58 10.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.389 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.15 -14.83 57.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.024 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.589 ' O ' ' OE1' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -69.96 -28.5 65.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.998 0.428 . . . . 0.0 111.199 -179.563 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.807 ' O ' HD12 ' A' ' 28' ' ' LEU . 6.7 mp -71.33 -62.85 1.25 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.406 0.622 . . . . 0.0 110.674 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.081 HD22 ' H ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -58.34 -42.37 86.7 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.395 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -62.57 -56.5 17.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.14 0.495 . . . . 0.0 110.841 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.679 ' OE1' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -49.73 -63.42 1.12 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.494 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.807 HD12 ' O ' ' A' ' 24' ' ' LEU . 1.1 mt -51.84 -51.65 55.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.013 0.435 . . . . 0.0 111.072 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.63 -22.56 46.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.552 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -85.35 -32.07 22.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.463 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.587 HG21 HG11 ' A' ' 55' ' ' VAL . 62.8 mt -78.9 -55.86 8.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.536 0.684 . . . . 0.0 110.943 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.529 ' OG1' ' CG1' ' A' ' 34' ' ' ILE . 3.0 p -78.09 -37.32 46.7 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.762 -178.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.9 36.75 12.68 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 -179.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.846 HG22 ' H ' ' A' ' 36' ' ' ASP . 1.5 mm -98.1 149.43 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.957 0.408 . . . . 0.0 110.851 -179.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -119.56 23.37 11.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.155 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.846 ' H ' HG22 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -120.03 69.04 13.47 Favored Pre-proline 0 N--CA 1.453 -0.325 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.982 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -35.51 -20.45 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.625 0 C-N-CA 122.864 2.376 . . . . 0.0 112.044 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.671 ' N ' ' O ' ' A' ' 36' ' ' ASP . 0.1 OUTLIER -74.76 -53.26 9.52 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.438 -179.328 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 1.081 ' CZ ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -69.78 -24.39 63.5 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 179.72 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.511 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 2.2 mt -67.47 -59.42 3.39 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.749 ' CE1' ' NZ ' ' A' ' 45' ' ' LYS . 1.2 t-80 -53.91 -26.39 24.87 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.814 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -64.95 -47.55 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 1.002 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -64.57 -46.39 82.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.66 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.719 HD21 HD22 ' A' ' 28' ' ' LEU . 4.6 mm? -56.14 -36.86 68.73 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.749 ' NZ ' ' CE1' ' A' ' 41' ' ' HIS . 25.9 mttp -68.93 -46.66 67.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.734 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.6 -22.12 64.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.918 0.39 . . . . 0.0 110.708 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.523 ' C ' ' CG ' ' A' ' 48' ' ' ASN . 62.4 p -90.57 17.6 7.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.489 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.531 ' ND2' ' OD2' ' A' ' 50' ' ' ASP . 0.6 OUTLIER 48.57 30.27 2.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.889 179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.0 -23.5 35.44 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 111.42 -0.672 . . . . 0.0 111.42 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.531 ' OD2' ' ND2' ' A' ' 48' ' ' ASN . 89.9 m-20 -58.26 115.44 2.95 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.138 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.706 ' O ' HG23 ' A' ' 55' ' ' VAL . 0.2 OUTLIER -69.27 -58.36 5.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.898 -179.255 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.601 ' N ' HG22 ' A' ' 51' ' ' ILE . 22.5 m -45.51 -57.15 4.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.012 0.434 . . . . 0.0 110.575 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.676 ' O ' HD12 ' A' ' 57' ' ' LEU . 8.9 mm100 -51.51 -59.09 4.64 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.609 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.547 ' HA ' HD13 ' A' ' 57' ' ' LEU . . . -39.03 -54.76 1.66 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.478 0.656 . . . . 0.0 109.338 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.722 ' O ' HG22 ' A' ' 59' ' ' THR . 41.2 t -45.18 -59.19 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.48 178.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 53' ' ' GLN . 5.0 t -43.93 -49.69 8.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.642 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 53' ' ' GLN . 5.2 mp -60.23 -30.31 69.32 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.249 0.547 . . . . 0.0 110.439 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.081 HD22 ' CZ ' ' A' ' 39' ' ' PHE . 41.4 mt -88.07 -14.53 38.66 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.295 -0.866 . . . . 0.0 113.082 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.722 HG22 ' O ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER -122.97 7.8 9.29 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.351 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.637 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -63.29 19.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.124 -179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.65 ' H ' ' C ' ' A' ' 59' ' ' THR . 20.6 tp10 92.32 55.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.133 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.59 ' NE ' ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -128.56 -90.99 0.49 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.204 0.526 . . . . 0.0 110.513 179.829 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.516 ' H ' ' CG ' ' A' ' 62' ' ' ARG . 9.2 t -64.05 -75.74 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.443 -0.798 . . . . 0.0 110.989 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.484 ' CB ' ' O ' ' A' ' 63' ' ' VAL . 4.2 mtmt 82.88 -158.81 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.496 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.48 ' OE2' ' O ' ' A' ' 32' ' ' THR . 36.0 mt-10 -145.51 153.16 51.12 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.302 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.596 ' O ' ' C ' ' A' ' 67' ' ' SER . 17.2 Cg_exo -52.73 -80.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 121.985 1.79 . . . . 0.0 112.07 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.708 ' O ' ' N ' ' A' ' 70' ' ' THR . 79.9 p 6.11 -105.58 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.794 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.524 ' C ' ' O ' ' A' ' 67' ' ' SER . 78.3 mm-40 -28.83 -49.16 0.07 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.833 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.595 ' N ' ' O ' ' A' ' 66' ' ' PRO . 0.9 OUTLIER -63.74 -37.61 88.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.36 0.6 . . . . 0.0 110.789 -179.636 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.708 ' N ' ' O ' ' A' ' 67' ' ' SER . 1.2 p -150.2 138.36 20.32 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.315 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.863 HG22 ' H ' ' A' ' 72' ' ' ALA . 2.3 p -116.11 -152.06 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.902 0.382 . . . . 0.0 110.63 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.863 ' H ' HG22 ' A' ' 71' ' ' VAL . . . -145.82 -83.08 0.14 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.489 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 74' ' ' GLU . 85.5 m -55.69 -103.39 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.514 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.584 ' H ' ' HD2' ' A' ' 75' ' ' PRO . 3.3 mt-10 -136.54 -65.66 0.02 OUTLIER Pre-proline 0 C--N 1.332 -0.189 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.1 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.584 ' HD2' ' H ' ' A' ' 74' ' ' GLU . 28.6 Cg_endo -64.67 -176.17 0.41 Allowed 'Trans proline' 0 N--CA 1.494 1.532 0 C-N-CA 122.335 2.023 . . . . 0.0 112.058 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.01 128.29 41.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.764 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -60.37 -11.54 6.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.475 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.531 HG12 ' N ' ' A' ' 79' ' ' GLU . 8.7 t -135.28 -124.3 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.495 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.531 ' N ' HG12 ' A' ' 78' ' ' VAL . 5.3 pt-20 -113.52 -164.59 0.93 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.588 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -97.81 -178.54 33.54 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.3 m -99.25 167.48 10.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.926 0.394 . . . . 0.0 110.653 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.497 ' O ' ' O ' ' A' ' 83' ' ' ALA . . . -81.26 -86.07 0.09 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.766 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.497 ' O ' ' O ' ' A' ' 82' ' ' ALA . . . 41.46 -169.77 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.687 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -172.88 -2.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.127 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.9 tttt -67.31 -160.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.398 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.451 ' C ' ' CG2' ' A' ' 87' ' ' VAL . 2.6 tp10 59.44 75.31 0.41 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.442 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.451 ' CG2' ' C ' ' A' ' 86' ' ' GLU . 1.1 t -152.63 125.85 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.123 0.487 . . . . 0.0 111.004 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.648 HD22 ' H ' ' A' ' 88' ' ' LEU . 0.6 OUTLIER -74.84 -28.34 60.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.685 0.755 . . . . 0.0 109.33 179.162 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 64.09 -160.73 0.29 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.522 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.04 148.75 31.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.019 0.438 . . . . 0.0 110.979 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.624 ' O ' HG22 ' A' ' 91' ' ' VAL . 7.6 p -132.98 -1.1 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.278 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.616 HG22 ' N ' ' A' ' 93' ' ' ASP . 41.9 mm 38.5 -100.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.984 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.616 ' N ' HG22 ' A' ' 92' ' ' ILE . 0.8 OUTLIER 167.51 112.54 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.096 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.603 ' O ' ' NE2' ' A' ' 96' ' ' HIS . 2.5 mp -137.92 -87.68 0.26 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.659 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.423 HG22 ' H ' ' A' ' 95' ' ' THR . 1.6 t -64.04 122.03 15.56 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.028 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.603 ' NE2' ' O ' ' A' ' 94' ' ' LEU . 0.1 OUTLIER -105.55 -158.82 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.912 179.531 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.471 ' OD1' ' N ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -108.51 89.16 2.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.158 179.803 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -112.01 -109.63 0.35 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.576 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.578 ' CG ' ' H ' ' A' ' 100' ' ' ASP . 0.9 OUTLIER -126.09 -143.55 0.3 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.73 0.776 . . . . 0.0 113.046 -178.116 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.578 ' H ' ' CG ' ' A' ' 99' ' ' LYS . 2.5 p30 -71.56 -19.79 62.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.968 -179.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -53.38 -60.64 3.04 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.107 -179.924 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.846 ' CD1' ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -84.21 -23.48 30.47 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.871 179.267 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.577 ' N ' HD22 ' A' ' 102' ' ' LEU . 1.1 mt-30 -67.94 -38.4 82.78 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 118.985 -1.086 . . . . 0.0 108.953 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.74 -51.98 9.03 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.689 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -57.62 -44.44 85.52 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.425 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.659 ' CG1' ' O ' ' A' ' 102' ' ' LEU . 4.7 mm -64.47 -43.87 96.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.038 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.27 -53.14 53.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.978 0.418 . . . . 0.0 110.793 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.74 HD23 ' O ' ' A' ' 108' ' ' LEU . 2.7 tt -54.77 -43.54 72.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.751 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.446 ' O ' ' N ' ' A' ' 113' ' ' SER . 0.5 OUTLIER -84.61 -19.85 32.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.47 -179.33 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.584 ' CB ' ' O ' ' A' ' 106' ' ' ILE . 3.7 tt -82.11 -19.31 40.35 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.103 0.478 . . . . 0.0 109.787 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.0 tp -62.24 -21.37 65.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.39 178.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -130.99 -57.61 1.03 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.134 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.446 ' N ' ' O ' ' A' ' 109' ' ' SER . 4.8 t 40.35 88.0 0.1 Allowed Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.151 -0.932 . . . . 0.0 111.028 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -65.94 -80.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 123.013 2.476 . . . . 0.0 111.867 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 11.1 mtmt -111.6 -140.22 0.38 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.614 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.55 ' O ' ' C ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -115.98 155.35 17.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.31 179.814 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.55 ' C ' ' O ' ' A' ' 116' ' ' ILE . 2.5 pt20 24.29 94.12 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.948 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -125.42 173.17 9.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.564 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -141.96 -77.87 0.26 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.677 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.745 0 CA-C-O 117.988 -1.451 . . . . 0.0 110.952 -179.924 . . . . . . . . 0 0 . 1 stop_ save_