data_2kvh_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 2kvh _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 32' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.81 167.96 10.78 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.274 -0.891 . . . . 0.0 109.457 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.76 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 45.3 t -82.92 -176.85 6.53 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.58 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 68.2 m -90.73 -64.3 1.15 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.239 -0.913 . . . . 0.0 109.516 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.692 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.5 tt -110.66 91.37 3.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.155 -0.965 . . . . 0.0 109.477 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.74 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.6 p 150.71 129.9 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.511 -0.743 . . . . 0.0 109.163 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.43 69.65 4.16 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.591 2.194 . . . . 0.0 112.165 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.615 HE22 ' CE1' ' A' ' 50' ' ' HIS . 3.9 pt20 -144.81 165.1 29.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.216 -0.927 . . . . 0.0 109.59 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 mtt180 -142.56 153.65 43.74 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.25 -0.906 . . . . 0.0 109.408 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 p -125.44 158.11 35.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -96.52 -22.88 16.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.223 -0.923 . . . . 0.0 109.567 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.54 140.33 27.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -47.7 -32.95 6.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.586 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.0 OUTLIER -50.07 -53.6 26.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.462 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.18 -38.06 63.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.333 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.2 ttt -58.79 -30.76 67.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.247 -0.908 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.586 ' OG1' ' O ' ' A' ' 45' ' ' SER . 18.0 p -67.26 -53.26 31.55 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.443 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 53' ' ' THR . 8.8 mtpp -52.07 -40.9 61.87 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.137 -0.977 . . . . 0.0 108.365 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.76 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.13 -42.35 63.26 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.689 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.438 HD22 ' N ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -71.0 -44.31 66.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.998 -1.064 . . . . 0.0 108.97 179.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 mtm-85 -68.79 -15.91 63.64 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.911 . . . . 0.0 108.72 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.52 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -104.06 -6.49 21.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.462 -0.774 . . . . 0.0 109.297 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.52 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.366 -0.834 . . . . 0.0 109.416 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 121.312 0.577 . . . . 0.0 109.506 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.45 154.7 23.26 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 109.447 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.761 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 49.5 t -78.83 -177.81 5.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.238 -0.914 . . . . 0.0 109.626 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.61 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 1.8 t -84.85 -82.68 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.262 -0.899 . . . . 0.0 109.529 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.675 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 3.8 tt -93.22 90.81 6.98 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.285 -0.884 . . . . 0.0 109.291 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.759 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.1 p 153.68 86.3 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -45.05 78.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.818 2.346 . . . . 0.0 112.342 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.669 HE21 ' C ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -145.32 138.85 26.64 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.194 -0.941 . . . . 0.0 109.442 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.676 ' N ' ' CD ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.81 135.06 53.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.278 -0.889 . . . . 0.0 109.462 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -140.48 147.59 39.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 109.506 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.19 -6.04 17.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.305 -0.872 . . . . 0.0 109.494 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.13 135.06 51.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 109.518 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.512 ' O ' ' N ' ' A' ' 48' ' ' THR . 4.9 t80 -50.16 -39.04 42.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.449 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.533 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.5 t -49.64 -59.94 3.33 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 109.254 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -26.67 68.62 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.197 -0.94 . . . . 0.0 109.194 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.4 ttp -80.18 -27.47 38.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.306 -0.871 . . . . 0.0 109.354 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.533 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.8 OUTLIER -70.43 -54.92 10.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.237 -0.914 . . . . 0.0 109.432 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 21.5 mttt -52.39 -36.4 53.98 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.761 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.14 -43.61 74.32 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.465 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.04 -33.5 68.05 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.092 -1.005 . . . . 0.0 108.799 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -79.9 -23.4 41.86 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -92.63 -10.28 37.96 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.077 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.441 -0.787 . . . . 0.0 109.595 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 121.254 0.55 . . . . 0.0 109.585 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.506 ' H ' ' HG ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -103.32 153.58 20.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.305 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.777 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 52.5 t -72.79 179.47 3.63 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.158 -0.964 . . . . 0.0 109.62 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.634 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 3.9 m -80.52 -74.48 0.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.241 -0.912 . . . . 0.0 109.849 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.674 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.8 tp -103.6 91.5 4.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.208 -0.932 . . . . 0.0 109.617 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.758 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.9 OUTLIER 154.54 93.58 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.372 -0.83 . . . . 0.0 109.255 179.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -48.39 79.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.748 2.299 . . . . 0.0 112.318 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 1.9 pt20 -153.36 142.48 21.37 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.293 -0.879 . . . . 0.0 109.546 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.74 140.47 48.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.451 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.41 172.27 8.46 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.131 -0.981 . . . . 0.0 109.479 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.434 ' HG3' ' H ' ' A' ' 43' ' ' ASP . 0.3 OUTLIER -116.36 -65.53 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.0 109.527 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.434 ' H ' ' HG3' ' A' ' 42' ' ' ARG . 5.0 t0 -96.11 -179.36 4.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.115 -0.991 . . . . 0.0 109.61 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 48' ' ' THR . 3.5 t80 -79.03 -37.32 39.4 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.227 -0.921 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.472 ' O ' ' OG1' ' A' ' 48' ' ' THR . 38.9 t -49.61 -50.35 43.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.196 -0.94 . . . . 0.0 109.197 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.37 -38.85 74.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.14 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.9 ttt -66.97 -31.84 72.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.346 -0.846 . . . . 0.0 109.278 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.472 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -66.3 -51.86 53.1 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.337 -0.852 . . . . 0.0 109.356 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.446 ' O ' ' N ' ' A' ' 53' ' ' THR . 37.6 mmtt -52.43 -41.39 63.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.777 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.2 -42.46 63.54 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.603 -0.686 . . . . 0.0 109.253 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.458 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -73.21 -40.53 64.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.976 -1.078 . . . . 0.0 108.906 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -71.32 -16.82 62.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.292 -0.88 . . . . 0.0 108.664 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -101.85 -5.83 24.31 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.515 -0.74 . . . . 0.0 109.167 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.442 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.349 -0.845 . . . . 0.0 109.503 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.23 0.538 . . . . 0.0 109.577 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.21 170.42 7.92 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.165 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.826 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 50.0 t -75.8 -179.39 4.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.0 109.603 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.611 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER -87.34 -70.57 0.61 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.283 -0.886 . . . . 0.0 109.778 -179.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 37.6 tp -110.08 91.77 3.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.17 -0.956 . . . . 0.0 109.925 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.801 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.2 p 152.93 103.45 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.427 -0.795 . . . . 0.0 109.175 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.3 79.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 122.621 2.214 . . . . 0.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.9 OUTLIER -145.14 140.57 28.08 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.277 -0.89 . . . . 0.0 109.483 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -119.83 140.18 51.21 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.325 -0.859 . . . . 0.0 109.25 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 32.9 p -141.36 167.64 21.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.139 -0.975 . . . . 0.0 109.592 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -129.97 -49.21 1.12 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 0.0 109.289 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -98.41 140.8 32.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.874 . . . . 0.0 109.273 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -52.93 -27.95 21.24 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.162 -0.961 . . . . 0.0 109.557 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.4 OUTLIER -57.8 -43.18 85.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.267 -0.895 . . . . 0.0 109.361 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.95 -36.21 31.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 109.389 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 ttm -68.32 -23.64 64.75 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.245 -0.909 . . . . 0.0 109.354 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 45' ' ' SER . 4.3 p -71.98 -53.62 12.43 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.239 -0.913 . . . . 0.0 109.312 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.1 mmmt -51.79 -36.57 48.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.826 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -53.53 -46.4 70.14 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.47 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -66.99 -34.71 78.35 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.059 -1.025 . . . . 0.0 108.574 179.744 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -78.58 -22.06 47.68 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -90.24 -13.73 34.82 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.499 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.449 -0.782 . . . . 0.0 109.457 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 81.6 p -107.52 163.95 12.63 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.226 -0.921 . . . . 0.0 109.406 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.766 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 29.5 t -83.52 -178.07 6.92 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.25 -0.906 . . . . 0.0 109.603 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.491 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.2 OUTLIER -88.55 -77.29 0.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.242 -0.911 . . . . 0.0 109.519 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.663 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 26.4 tp -100.18 91.2 4.64 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.212 -0.93 . . . . 0.0 109.263 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.756 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.9 OUTLIER 154.96 93.23 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 109.151 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.39 79.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.806 2.338 . . . . 0.0 112.386 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.789 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 4.1 pt20 -156.15 154.52 31.0 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.127 -0.983 . . . . 0.0 109.628 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 mtm-85 -132.88 154.31 50.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.318 -0.864 . . . . 0.0 109.485 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -130.44 177.42 7.37 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.18 -0.95 . . . . 0.0 109.461 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -126.19 -46.49 1.65 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.392 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.505 ' O ' ' C ' ' A' ' 44' ' ' PHE . 0.4 OUTLIER -116.12 136.03 53.39 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.335 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.505 ' C ' ' O ' ' A' ' 43' ' ' ASP . 6.5 t80 -38.19 -35.55 0.17 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.179 -0.951 . . . . 0.0 109.438 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.45 ' OG ' ' N ' ' A' ' 46' ' ' ALA . 18.2 p -50.81 -57.26 8.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.229 -0.919 . . . . 0.0 109.415 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.45 ' N ' ' OG ' ' A' ' 45' ' ' SER . . . -68.03 -33.82 75.31 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.316 -0.865 . . . . 0.0 109.42 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -37.91 87.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.447 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 44' ' ' PHE . 0.1 OUTLIER -63.93 -50.27 69.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.555 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 53' ' ' THR . 17.9 mttt -52.95 -42.83 65.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.082 -1.011 . . . . 0.0 108.428 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.789 ' CE1' ' NE2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -52.81 -43.02 65.64 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.63 -0.669 . . . . 0.0 109.31 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -73.26 -38.22 66.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.039 -1.038 . . . . 0.0 108.992 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -74.03 -17.75 60.93 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.264 -0.897 . . . . 0.0 108.643 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.549 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -101.33 -8.97 21.6 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.447 -0.783 . . . . 0.0 109.092 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.549 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.467 -0.771 . . . . 0.0 109.475 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 56.1 p -87.88 153.53 21.25 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 0.0 109.339 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.76 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 45.9 t -77.79 -177.72 5.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.268 -0.895 . . . . 0.0 109.617 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.576 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 35.6 t -91.26 -63.69 1.23 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.216 -0.927 . . . . 0.0 109.491 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.709 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 0.7 OUTLIER -109.62 91.32 3.6 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.151 -0.968 . . . . 0.0 109.58 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.758 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.5 p 150.81 94.34 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.493 -0.754 . . . . 0.0 109.134 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -47.05 75.92 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.719 2.279 . . . . 0.0 112.126 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.692 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 5.8 pt20 -148.89 146.14 27.77 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -0.877 . . . . 0.0 109.505 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -123.0 143.81 49.68 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.495 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.5 p -130.4 -169.98 2.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.293 -0.88 . . . . 0.0 109.504 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.02 -49.94 0.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.619 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.34 137.49 40.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.466 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.678 ' CD2' ' CG2' ' A' ' 48' ' ' THR . 2.3 t80 -45.17 -40.03 6.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.897 . . . . 0.0 109.432 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.0 -42.34 48.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.288 -0.883 . . . . 0.0 109.499 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.2 -32.92 22.4 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.241 -0.912 . . . . 0.0 109.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.3 ttp -74.77 -23.56 58.55 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.343 -0.848 . . . . 0.0 109.37 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.678 ' CG2' ' CD2' ' A' ' 44' ' ' PHE . 26.0 p -76.44 -50.48 13.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 53' ' ' THR . 18.3 mttt -51.55 -38.52 54.68 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.76 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -53.81 -47.03 71.27 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.52 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.482 HD22 ' N ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -72.87 -34.83 66.97 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.071 -1.018 . . . . 0.0 108.643 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.46 -15.21 60.44 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.524 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -109.38 -0.51 18.98 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.57 -0.706 . . . . 0.0 109.214 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.458 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.272 -0.893 . . . . 0.0 109.458 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.87 152.14 18.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.368 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.752 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 37.7 t -77.75 -176.25 4.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 109.543 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.53 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 48.4 t -91.78 -72.4 0.59 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.391 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 8.3 tt -102.79 91.76 4.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.752 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.4 p 151.66 92.1 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.615 -0.678 . . . . 0.0 109.206 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -46.53 79.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.721 2.281 . . . . 0.0 112.283 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 37' ' ' CYS . 10.6 pt20 -151.29 141.66 22.43 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 40' ' ' ARG . 7.9 mtp-105 -125.18 131.95 53.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.196 -0.94 . . . . 0.0 109.586 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.85 150.02 29.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.337 -0.852 . . . . 0.0 109.24 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -89.38 -19.31 25.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.184 -0.947 . . . . 0.0 109.543 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.3 144.5 34.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.246 -0.909 . . . . 0.0 109.435 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -58.03 -35.31 71.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.308 -0.87 . . . . 0.0 109.568 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.436 ' HG ' ' N ' ' A' ' 46' ' ' ALA . 2.6 p -49.42 -39.5 33.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.222 -0.924 . . . . 0.0 109.178 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.436 ' N ' ' HG ' ' A' ' 45' ' ' SER . . . -85.66 -27.75 25.17 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.291 -0.881 . . . . 0.0 109.07 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.5 ttt -70.09 -28.05 65.1 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.339 -0.85 . . . . 0.0 109.142 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.6 p -67.31 -51.47 52.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.204 -0.935 . . . . 0.0 109.155 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 53' ' ' THR . 11.1 mttt -53.33 -38.97 63.71 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.72 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.92 -42.05 68.36 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.602 -0.686 . . . . 0.0 109.168 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.433 HD23 ' CG ' ' A' ' 50' ' ' HIS . 0.3 OUTLIER -72.88 -39.97 65.98 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.048 -1.033 . . . . 0.0 108.844 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.411 ' HG2' ' NH1' ' A' ' 52' ' ' ARG . 5.2 tpp85 -73.08 -16.7 61.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.539 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -103.83 -5.49 22.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.448 -0.783 . . . . 0.0 109.091 179.671 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.539 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.483 -0.761 . . . . 0.0 109.631 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.256 0.55 . . . . 0.0 109.665 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.526 ' H ' ' HG ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -105.9 158.71 16.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.227 -0.921 . . . . 0.0 109.3 179.831 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.797 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 51.3 t -73.02 -179.15 3.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.163 -0.961 . . . . 0.0 109.625 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.617 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.6 OUTLIER -89.65 -48.42 7.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.324 -0.86 . . . . 0.0 109.57 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.5 tp -127.47 91.47 3.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.221 -0.924 . . . . 0.0 109.614 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.775 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.6 p 150.01 134.64 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.592 -0.693 . . . . 0.0 109.146 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.4 76.61 3.1 Favored 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.703 2.269 . . . . 0.0 112.313 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 14.0 pt20 -151.54 142.75 23.27 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.187 -0.946 . . . . 0.0 109.424 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HD3' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -122.24 150.45 42.28 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.351 -0.843 . . . . 0.0 109.485 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.452 ' HG ' ' HB2' ' A' ' 47' ' ' MET . 24.1 p -125.9 -172.23 2.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 109.497 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -117.48 -59.53 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -112.98 163.41 14.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.273 -0.892 . . . . 0.0 109.413 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.462 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 18.3 t80 -62.16 -32.98 73.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.308 -0.87 . . . . 0.0 109.348 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.55 ' O ' ' OG1' ' A' ' 48' ' ' THR . 2.3 p -53.5 -45.2 69.59 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.293 -0.879 . . . . 0.0 109.419 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.78 -42.3 28.25 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -0.896 . . . . 0.0 109.4 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.452 ' HB2' ' HG ' ' A' ' 41' ' ' SER . 15.8 ttt -58.81 -27.38 65.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.412 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 45' ' ' SER . 7.9 p -68.25 -50.76 51.73 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.211 -0.93 . . . . 0.0 109.463 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 53' ' ' THR . 2.0 mtpt -52.68 -38.55 60.75 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.797 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.9 -43.7 77.52 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.674 -0.641 . . . . 0.0 109.287 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.419 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -70.82 -36.94 73.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.987 -1.071 . . . . 0.0 108.892 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -76.1 -23.28 54.95 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.562 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -94.76 -8.3 37.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.471 -0.768 . . . . 0.0 109.139 179.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.562 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.342 -0.849 . . . . 0.0 109.512 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.315 0.579 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -92.65 165.68 12.86 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.313 -0.867 . . . . 0.0 109.212 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.834 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 35.6 t -74.51 -179.78 4.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.143 -0.973 . . . . 0.0 109.592 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.746 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -84.55 -44.38 13.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.341 -0.849 . . . . 0.0 109.712 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.685 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 6.1 tt -136.94 92.05 2.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.111 -0.993 . . . . 0.0 109.992 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.805 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.3 p 152.36 139.1 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.441 -0.787 . . . . 0.0 109.273 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.18 75.79 2.76 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.721 2.281 . . . . 0.0 112.255 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.695 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 7.3 pt20 -150.79 140.66 21.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.139 -0.975 . . . . 0.0 109.516 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HD2' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -128.71 153.63 47.14 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.211 -0.93 . . . . 0.0 109.473 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.41 162.83 33.44 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.205 -0.935 . . . . 0.0 109.49 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtp85 -103.07 -35.13 8.63 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.171 -0.956 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.38 140.77 52.64 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.257 -0.902 . . . . 0.0 109.443 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -47.71 -33.97 7.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.261 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.554 ' O ' ' OG1' ' A' ' 48' ' ' THR . 53.6 p -49.53 -55.53 13.05 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.897 . . . . 0.0 109.212 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.68 -28.55 63.8 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.301 -0.874 . . . . 0.0 109.185 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.452 ' O ' ' CD1' ' A' ' 51' ' ' LEU . 10.3 ttt -72.11 -25.48 61.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.277 -0.89 . . . . 0.0 109.255 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.554 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -72.0 -48.85 41.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.184 -0.947 . . . . 0.0 109.371 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 53' ' ' THR . 7.4 mmtp -51.89 -37.85 53.95 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.834 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.32 -48.47 65.4 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.452 ' CD1' ' O ' ' A' ' 47' ' ' MET . 7.3 mp -64.24 -38.96 92.93 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.009 -1.057 . . . . 0.0 108.618 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -73.84 -20.32 60.48 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.53 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -97.98 -9.43 26.14 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.466 -0.771 . . . . 0.0 109.114 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.53 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 109.364 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.93 156.49 23.9 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.25 -0.906 . . . . 0.0 109.536 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.773 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 35.1 t -73.83 178.81 4.61 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 109.512 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.71 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -70.26 -81.69 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.274 -0.891 . . . . 0.0 109.704 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.661 ' C ' ' SG ' ' A' ' 37' ' ' CYS . 33.7 tp -102.1 91.67 4.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.273 -0.892 . . . . 0.0 109.566 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.744 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER 156.82 94.16 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.413 -0.804 . . . . 0.0 109.283 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -47.93 79.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.726 2.284 . . . . 0.0 112.317 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.566 ' OE1' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -146.84 134.56 21.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.482 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.74 133.62 53.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.564 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.71 162.63 19.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.96 . . . . 0.0 109.441 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 43' ' ' ASP . 19.1 ttt-85 -118.59 -6.8 10.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.545 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.502 ' OD1' ' O ' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -146.4 163.28 36.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.198 -0.939 . . . . 0.0 109.487 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.441 ' CE2' HG22 ' A' ' 48' ' ' THR . 23.2 t80 -71.24 -39.99 71.31 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.581 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.7 OUTLIER -49.68 -55.58 13.28 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.293 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.95 -29.55 70.48 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.224 -0.923 . . . . 0.0 109.127 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.3 ttt -73.89 -32.5 63.62 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.392 -0.817 . . . . 0.0 109.334 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.581 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.8 OUTLIER -64.28 -53.05 55.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -0.9 . . . . 0.0 109.358 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 53' ' ' THR . 38.9 mttm -54.23 -37.81 65.02 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.19 -0.944 . . . . 0.0 108.486 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.773 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.81 -40.92 73.41 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.636 -0.665 . . . . 0.0 109.297 179.638 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.54 -37.61 68.25 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.04 -1.037 . . . . 0.0 108.917 179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -76.29 -22.64 54.8 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.568 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -93.59 -10.91 33.08 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.532 -0.73 . . . . 0.0 109.039 179.639 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.568 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.399 -0.813 . . . . 0.0 109.645 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.267 0.556 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.516 ' H ' ' HG ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -109.45 159.0 17.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.292 -0.88 . . . . 0.0 109.374 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.793 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 42.5 t -77.64 -178.62 5.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.547 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.588 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 91.7 p -85.86 -67.23 0.82 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.681 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 31.0 tp -111.56 92.8 4.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.675 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.756 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.3 p 152.59 97.13 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.483 -0.761 . . . . 0.0 109.315 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -48.02 76.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.657 2.238 . . . . 0.0 112.308 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.7 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 3.5 pt20 -151.54 141.44 22.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.245 -0.909 . . . . 0.0 109.461 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.3 mtt180 -117.18 162.54 17.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.263 -0.898 . . . . 0.0 109.725 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.558 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 6.5 p -145.0 150.72 37.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.292 -0.88 . . . . 0.0 109.494 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -90.18 -46.5 8.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 0.0 109.35 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.16 161.52 17.04 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.279 -0.888 . . . . 0.0 109.345 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -67.36 -34.05 76.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.588 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.6 t -49.71 -57.48 7.17 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.919 . . . . 0.0 109.201 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.74 -34.41 77.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.866 . . . . 0.0 109.142 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.558 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 2.7 ttt -69.26 -29.4 67.29 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.32 -0.863 . . . . 0.0 109.433 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.588 ' OG1' ' O ' ' A' ' 45' ' ' SER . 38.1 p -69.66 -49.17 56.18 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.209 -0.932 . . . . 0.0 109.408 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.564 ' H ' ' HG1' ' A' ' 48' ' ' THR . 9.0 mttm -51.79 -40.08 59.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.793 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.32 -49.0 65.12 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.467 ' N ' HD11 ' A' ' 51' ' ' LEU . 9.9 mp -56.42 -46.8 80.05 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.151 -0.968 . . . . 0.0 108.756 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.18 -18.24 62.49 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.558 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -98.75 -5.26 31.7 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.443 -0.785 . . . . 0.0 109.065 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.366 -0.834 . . . . 0.0 109.365 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.247 0.546 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -79.31 170.24 16.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.34 -0.85 . . . . 0.0 109.362 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.805 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 19.6 t -81.07 179.02 8.05 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.723 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.757 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -78.79 -51.53 9.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.344 -0.847 . . . . 0.0 109.711 -179.872 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.713 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 4.5 tt -136.86 99.04 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.115 -0.991 . . . . 0.0 109.76 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.79 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.7 p 148.34 143.76 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.618 -0.676 . . . . 0.0 109.199 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -74.86 74.3 3.97 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.654 2.236 . . . . 0.0 112.34 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.665 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 6.1 pt20 -152.88 148.99 27.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -136.01 148.1 48.26 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.179 -0.951 . . . . 0.0 109.658 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 p -128.31 164.95 21.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 109.486 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.83 -46.87 4.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.168 -0.958 . . . . 0.0 109.379 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -112.88 159.49 18.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.365 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.734 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 22.7 t80 -59.63 -36.75 76.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.576 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.5 OUTLIER -49.72 -58.85 4.51 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 109.35 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.65 -33.21 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -28.62 63.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.314 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.734 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 1.6 p -71.13 -52.09 21.27 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -0.913 . . . . 0.0 109.451 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 53' ' ' THR . 13.6 mttt -52.04 -40.03 60.47 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.131 -0.981 . . . . 0.0 108.379 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.805 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.41 -43.9 65.06 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.692 -0.63 . . . . 0.0 109.309 179.587 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 54' ' ' HIS . 0.4 OUTLIER -67.93 -40.3 83.35 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.09 -1.007 . . . . 0.0 108.727 179.869 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -72.87 -19.2 61.34 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.447 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -100.67 -4.27 28.65 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.373 -0.829 . . . . 0.0 109.489 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.296 0.57 . . . . 0.0 109.667 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.7 152.43 26.55 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.333 -0.854 . . . . 0.0 109.114 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.767 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 38.2 t -76.11 -179.18 4.82 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.072 -1.018 . . . . 0.0 109.636 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.508 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 18.2 m -82.87 -89.16 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 0.0 109.486 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.663 ' C ' ' SG ' ' A' ' 37' ' ' CYS . 7.4 tt -91.25 91.12 8.05 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.169 -0.957 . . . . 0.0 109.106 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.751 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER 158.55 91.81 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.501 -0.749 . . . . 0.0 109.088 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -46.8 79.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.95 2.433 . . . . 0.0 112.475 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -148.93 136.55 20.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.195 -0.94 . . . . 0.0 109.552 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -127.62 126.84 42.77 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.285 -0.884 . . . . 0.0 109.38 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.681 ' HG ' ' N ' ' A' ' 42' ' ' ARG . 1.4 p -116.06 -167.2 1.23 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.949 . . . . 0.0 109.715 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.681 ' N ' ' HG ' ' A' ' 41' ' ' SER . 36.8 mmt-85 -128.0 -47.17 1.37 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -0.856 . . . . 0.0 109.319 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.74 174.07 6.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.34 -0.85 . . . . 0.0 109.293 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.457 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.4 OUTLIER -75.05 -33.82 61.78 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.0 109.495 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 m -52.22 -43.37 64.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.261 -0.9 . . . . 0.0 109.484 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.98 -35.03 20.67 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.364 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.646 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 1.8 tpt -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.222 -0.924 . . . . 0.0 109.398 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.457 ' OG1' ' O ' ' A' ' 44' ' ' PHE . 1.4 p -69.05 -46.05 68.85 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.223 -0.923 . . . . 0.0 109.41 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.4 mttt -53.01 -38.66 62.54 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.767 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -53.42 -45.9 69.56 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.569 -0.707 . . . . 0.0 109.348 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.453 ' N ' ' CD1' ' A' ' 51' ' ' LEU . 7.1 mp -66.46 -39.59 88.91 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.046 -1.034 . . . . 0.0 108.873 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -74.65 -19.33 60.32 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.374 -0.828 . . . . 0.0 108.844 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.56 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -96.61 -12.04 24.49 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.413 -0.804 . . . . 0.0 109.01 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.56 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.501 -0.749 . . . . 0.0 109.511 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.73 158.4 23.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.258 -0.902 . . . . 0.0 109.431 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.782 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 42.7 t -69.79 -176.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.397 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.77 -65.03 1.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.881 . . . . 0.0 109.457 -179.927 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.668 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 60.3 tp -114.79 91.82 3.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.248 -0.908 . . . . 0.0 109.514 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.756 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.9 OUTLIER 154.72 101.27 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.364 -0.835 . . . . 0.0 109.323 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -47.99 72.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.633 0 C-N-CA 122.676 2.251 . . . . 0.0 112.212 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -140.17 147.74 40.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.421 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -121.52 145.19 48.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.22 -0.925 . . . . 0.0 109.599 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.51 140.15 42.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.315 -0.866 . . . . 0.0 109.39 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.495 ' CG ' ' N ' ' A' ' 43' ' ' ASP . 5.9 ptp180 -95.97 -42.45 8.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.254 -0.904 . . . . 0.0 109.561 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.495 ' N ' ' CG ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -115.07 161.8 17.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.926 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 32.1 t80 -65.42 -33.37 75.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.886 . . . . 0.0 109.283 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.453 ' O ' ' OG1' ' A' ' 48' ' ' THR . 5.7 m -50.04 -50.91 46.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.348 -0.845 . . . . 0.0 109.37 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.57 -28.06 58.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.241 -0.912 . . . . 0.0 109.398 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' MET . . . . . 0.447 ' O ' ' CD2' ' A' ' 51' ' ' LEU . 8.0 ttt -72.22 -22.53 61.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.284 -0.885 . . . . 0.0 109.339 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.574 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -77.09 -53.31 7.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.209 -0.932 . . . . 0.0 109.536 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 53' ' ' THR . 32.3 mttt -52.06 -38.59 57.61 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.166 -0.959 . . . . 0.0 108.48 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.782 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.45 -43.86 75.81 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.606 -0.684 . . . . 0.0 109.282 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.452 ' N ' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -73.43 -32.25 64.29 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.068 -1.02 . . . . 0.0 109.01 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.52 -31.08 53.22 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.52 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.8 OUTLIER -84.35 -15.04 47.88 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.497 -0.752 . . . . 0.0 109.128 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.52 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 109.469 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.85 161.38 18.34 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.342 -0.849 . . . . 0.0 109.49 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.791 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 35.5 t -72.62 179.74 3.42 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.221 -0.924 . . . . 0.0 109.346 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.718 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -82.91 -43.09 16.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.159 -0.963 . . . . 0.0 109.751 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.0 OUTLIER -137.08 91.86 2.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.0 110.051 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.2 p 153.14 137.52 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.437 -0.789 . . . . 0.0 109.527 179.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.88 71.92 2.67 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.756 2.304 . . . . 0.0 112.209 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.851 HE21 ' CD2' ' A' ' 50' ' ' HIS . 9.2 pt20 -153.43 163.26 40.25 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.25 -0.906 . . . . 0.0 109.349 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -140.8 146.81 38.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.247 -0.908 . . . . 0.0 109.683 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.64 159.18 32.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.32 -0.862 . . . . 0.0 109.471 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.477 HH11 ' HD2' ' A' ' 42' ' ' ARG . 24.4 mtm105 -90.17 -72.77 0.55 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.25 153.63 19.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.537 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.476 ' CD2' ' CG2' ' A' ' 48' ' ' THR . 7.0 t80 -58.72 -35.56 72.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.0 109.32 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -44.8 45.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 109.141 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.48 -33.12 48.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.357 -0.839 . . . . 0.0 109.097 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.12 63.51 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.313 -0.867 . . . . 0.0 109.255 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.476 ' CG2' ' CD2' ' A' ' 44' ' ' PHE . 3.4 p -70.59 -52.18 23.26 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.877 . . . . 0.0 109.309 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -51.99 -39.06 58.81 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.851 ' CD2' HE21 ' A' ' 39' ' ' GLN . 0.0 OUTLIER -51.9 -44.5 63.82 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 54' ' ' HIS . 1.9 mt -61.28 -45.53 94.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.141 -0.974 . . . . 0.0 108.931 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -71.08 -19.51 62.46 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.582 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.4 OUTLIER -100.01 -5.0 28.81 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.582 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 109.636 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.587 ' O ' ' O ' ' A' ' 31' ' ' PRO . 0.0 OUTLIER -93.52 169.53 10.03 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.295 -0.878 . . . . 0.0 109.441 -179.879 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.587 ' O ' ' O ' ' A' ' 30' ' ' LYS . 53.2 Cg_exo -46.81 -161.73 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.753 2.302 . . . . 0.0 112.181 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -100.05 102.2 13.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.177 -0.952 . . . . 0.0 109.502 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.81 167.96 10.78 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.274 -0.891 . . . . 0.0 109.457 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.58 ' SG ' ' N ' ' A' ' 35' ' ' SER . 45.3 t -82.92 -176.85 6.53 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.58 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 68.2 m -90.73 -64.3 1.15 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.239 -0.913 . . . . 0.0 109.516 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.692 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.5 tt -110.66 91.37 3.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.155 -0.965 . . . . 0.0 109.477 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.692 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.6 p 150.71 129.9 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.511 -0.743 . . . . 0.0 109.163 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.43 69.65 4.16 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.591 2.194 . . . . 0.0 112.165 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.615 HE22 ' CE1' ' A' ' 50' ' ' HIS . 3.9 pt20 -144.81 165.1 29.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.216 -0.927 . . . . 0.0 109.59 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 mtt180 -142.56 153.65 43.74 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.25 -0.906 . . . . 0.0 109.408 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 p -125.44 158.11 35.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -96.52 -22.88 16.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.223 -0.923 . . . . 0.0 109.567 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.54 140.33 27.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -47.7 -32.95 6.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.586 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.0 OUTLIER -50.07 -53.6 26.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.462 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.18 -38.06 63.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.333 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.2 ttt -58.79 -30.76 67.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.247 -0.908 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.586 ' OG1' ' O ' ' A' ' 45' ' ' SER . 18.0 p -67.26 -53.26 31.55 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.443 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 53' ' ' THR . 8.8 mtpp -52.07 -40.9 61.87 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.137 -0.977 . . . . 0.0 108.365 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.743 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.13 -42.35 63.26 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.689 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.438 HD22 ' N ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -71.0 -44.31 66.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.998 -1.064 . . . . 0.0 108.97 179.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 mtm-85 -68.79 -15.91 63.64 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.911 . . . . 0.0 108.72 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.52 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -104.06 -6.49 21.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.462 -0.774 . . . . 0.0 109.297 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.52 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -34.88 -75.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.366 -0.834 . . . . 0.0 109.416 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.271 0 CA-C-O 117.978 -1.457 . . . . 0.0 109.535 179.996 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.304 0.573 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.7 tttp -116.23 91.02 31.12 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.224 -0.923 . . . . 0.0 109.372 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -78.12 -161.32 0.14 Allowed 'Trans proline' 0 C--N 1.306 -1.681 0 C-N-CA 122.773 2.315 . . . . 0.0 112.298 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.32 71.14 0.94 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.179 -0.951 . . . . 0.0 109.506 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.45 154.7 23.26 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 109.447 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.61 ' SG ' ' N ' ' A' ' 35' ' ' SER . 49.5 t -78.83 -177.81 5.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.238 -0.914 . . . . 0.0 109.626 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.61 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 1.8 t -84.85 -82.68 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.262 -0.899 . . . . 0.0 109.529 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.675 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 3.8 tt -93.22 90.81 6.98 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.285 -0.884 . . . . 0.0 109.291 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.675 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.1 p 153.68 86.3 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -45.05 78.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.818 2.346 . . . . 0.0 112.342 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.669 HE21 ' C ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -145.32 138.85 26.64 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.194 -0.941 . . . . 0.0 109.442 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.676 ' N ' ' CD ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.81 135.06 53.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.278 -0.889 . . . . 0.0 109.462 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -140.48 147.59 39.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 109.506 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.19 -6.04 17.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.305 -0.872 . . . . 0.0 109.494 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.13 135.06 51.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 109.518 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.512 ' O ' ' N ' ' A' ' 48' ' ' THR . 4.9 t80 -50.16 -39.04 42.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.449 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.533 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.5 t -49.64 -59.94 3.33 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 109.254 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -26.67 68.62 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.197 -0.94 . . . . 0.0 109.194 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.4 ttp -80.18 -27.47 38.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.306 -0.871 . . . . 0.0 109.354 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.533 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.8 OUTLIER -70.43 -54.92 10.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.237 -0.914 . . . . 0.0 109.432 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 21.5 mttt -52.39 -36.4 53.98 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.687 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.14 -43.61 74.32 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.465 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.04 -33.5 68.05 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.092 -1.005 . . . . 0.0 108.799 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -79.9 -23.4 41.86 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -92.63 -10.28 37.96 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.077 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -33.0 -82.25 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.441 -0.787 . . . . 0.0 109.595 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 CA-C-O 117.988 -1.451 . . . . 0.0 109.541 -179.973 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.32 0.581 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.86 158.43 37.81 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 0.0 109.36 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -44.83 117.26 1.44 Allowed 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.699 2.266 . . . . 0.0 112.158 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -147.35 133.54 19.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.209 -0.932 . . . . 0.0 109.585 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.506 ' H ' ' HG ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -103.32 153.58 20.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.305 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.634 ' SG ' ' N ' ' A' ' 35' ' ' SER . 52.5 t -72.79 179.47 3.63 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.158 -0.964 . . . . 0.0 109.62 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.634 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 3.9 m -80.52 -74.48 0.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.241 -0.912 . . . . 0.0 109.849 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.674 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.8 tp -103.6 91.5 4.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.208 -0.932 . . . . 0.0 109.617 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.674 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 0.9 OUTLIER 154.54 93.58 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.372 -0.83 . . . . 0.0 109.255 179.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -48.39 79.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.748 2.299 . . . . 0.0 112.318 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 1.9 pt20 -153.36 142.48 21.37 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.293 -0.879 . . . . 0.0 109.546 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.74 140.47 48.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.451 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.41 172.27 8.46 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.131 -0.981 . . . . 0.0 109.479 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.434 ' HG3' ' H ' ' A' ' 43' ' ' ASP . 0.3 OUTLIER -116.36 -65.53 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.0 109.527 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.434 ' H ' ' HG3' ' A' ' 42' ' ' ARG . 5.0 t0 -96.11 -179.36 4.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.115 -0.991 . . . . 0.0 109.61 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 48' ' ' THR . 3.5 t80 -79.03 -37.32 39.4 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.227 -0.921 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.472 ' O ' ' OG1' ' A' ' 48' ' ' THR . 38.9 t -49.61 -50.35 43.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.196 -0.94 . . . . 0.0 109.197 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.37 -38.85 74.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.14 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.9 ttt -66.97 -31.84 72.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.346 -0.846 . . . . 0.0 109.278 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.472 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -66.3 -51.86 53.1 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.337 -0.852 . . . . 0.0 109.356 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.446 ' O ' ' N ' ' A' ' 53' ' ' THR . 37.6 mmtt -52.43 -41.39 63.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.714 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.2 -42.46 63.54 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.603 -0.686 . . . . 0.0 109.253 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.458 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -73.21 -40.53 64.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.976 -1.078 . . . . 0.0 108.906 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -71.32 -16.82 62.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.292 -0.88 . . . . 0.0 108.664 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.446 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -101.85 -5.83 24.31 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.515 -0.74 . . . . 0.0 109.167 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.526 ' O ' ' C ' ' A' ' 55' ' ' GLY . 0.1 OUTLIER -41.28 120.87 1.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.349 -0.845 . . . . 0.0 109.503 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.526 ' C ' ' O ' ' A' ' 54' ' ' HIS . . . . . . . . 0 N--CA 1.49 2.288 0 CA-C-O 118.016 -1.436 . . . . 0.0 109.527 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -114.3 86.9 12.65 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.279 -0.888 . . . . 0.0 109.46 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -78.5 -173.98 2.08 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.748 2.299 . . . . 0.0 112.217 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.84 124.65 26.51 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.226 -0.921 . . . . 0.0 109.577 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.21 170.42 7.92 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.165 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.611 ' SG ' ' N ' ' A' ' 35' ' ' SER . 50.0 t -75.8 -179.39 4.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.0 109.603 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.611 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER -87.34 -70.57 0.61 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.283 -0.886 . . . . 0.0 109.778 -179.699 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 37.6 tp -110.08 91.77 3.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.17 -0.956 . . . . 0.0 109.925 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.682 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.2 p 152.93 103.45 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.427 -0.795 . . . . 0.0 109.175 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.3 79.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 122.621 2.214 . . . . 0.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.9 OUTLIER -145.14 140.57 28.08 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.277 -0.89 . . . . 0.0 109.483 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -119.83 140.18 51.21 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.325 -0.859 . . . . 0.0 109.25 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 32.9 p -141.36 167.64 21.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.139 -0.975 . . . . 0.0 109.592 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -129.97 -49.21 1.12 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 0.0 109.289 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -98.41 140.8 32.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.874 . . . . 0.0 109.273 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -52.93 -27.95 21.24 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.162 -0.961 . . . . 0.0 109.557 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.4 OUTLIER -57.8 -43.18 85.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.267 -0.895 . . . . 0.0 109.361 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.95 -36.21 31.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 109.389 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 ttm -68.32 -23.64 64.75 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.245 -0.909 . . . . 0.0 109.354 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 45' ' ' SER . 4.3 p -71.98 -53.62 12.43 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.239 -0.913 . . . . 0.0 109.312 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.1 mmmt -51.79 -36.57 48.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.68 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.53 -46.4 70.14 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.47 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -66.99 -34.71 78.35 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.059 -1.025 . . . . 0.0 108.574 179.744 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -78.58 -22.06 47.68 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -90.24 -13.73 34.82 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.499 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -38.31 119.36 0.8 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.449 -0.782 . . . . 0.0 109.457 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 CA-C-O 118.028 -1.429 . . . . 0.0 109.535 179.987 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.327 0.584 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.0 mttm -116.26 97.61 49.98 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.187 -0.946 . . . . 0.0 109.349 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -77.07 -99.35 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.682 2.254 . . . . 0.0 112.247 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -142.55 109.23 5.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -0.934 . . . . 0.0 109.525 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 81.6 p -107.52 163.95 12.63 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.226 -0.921 . . . . 0.0 109.406 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 35' ' ' SER . 29.5 t -83.52 -178.07 6.92 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.25 -0.906 . . . . 0.0 109.603 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.491 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.2 OUTLIER -88.55 -77.29 0.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.242 -0.911 . . . . 0.0 109.519 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.663 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 26.4 tp -100.18 91.2 4.64 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.212 -0.93 . . . . 0.0 109.263 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.663 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 0.9 OUTLIER 154.96 93.23 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 109.151 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.39 79.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.806 2.338 . . . . 0.0 112.386 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.789 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 4.1 pt20 -156.15 154.52 31.0 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.127 -0.983 . . . . 0.0 109.628 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 mtm-85 -132.88 154.31 50.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.318 -0.864 . . . . 0.0 109.485 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -130.44 177.42 7.37 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.18 -0.95 . . . . 0.0 109.461 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -126.19 -46.49 1.65 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.392 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.505 ' O ' ' C ' ' A' ' 44' ' ' PHE . 0.4 OUTLIER -116.12 136.03 53.39 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.335 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.505 ' C ' ' O ' ' A' ' 43' ' ' ASP . 6.5 t80 -38.19 -35.55 0.17 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.179 -0.951 . . . . 0.0 109.438 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.45 ' OG ' ' N ' ' A' ' 46' ' ' ALA . 18.2 p -50.81 -57.26 8.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.229 -0.919 . . . . 0.0 109.415 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.45 ' N ' ' OG ' ' A' ' 45' ' ' SER . . . -68.03 -33.82 75.31 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.316 -0.865 . . . . 0.0 109.42 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -37.91 87.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.447 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 44' ' ' PHE . 0.1 OUTLIER -63.93 -50.27 69.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.555 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 53' ' ' THR . 17.9 mttt -52.95 -42.83 65.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.082 -1.011 . . . . 0.0 108.428 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.789 ' CE1' ' NE2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -52.81 -43.02 65.64 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.63 -0.669 . . . . 0.0 109.31 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -73.26 -38.22 66.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.039 -1.038 . . . . 0.0 108.992 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -74.03 -17.75 60.93 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.264 -0.897 . . . . 0.0 108.643 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.549 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -101.33 -8.97 21.6 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.447 -0.783 . . . . 0.0 109.092 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.549 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -34.36 102.29 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.467 -0.771 . . . . 0.0 109.475 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.495 ' O ' ' O ' ' A' ' 54' ' ' HIS . . . . . . . . 0 N--CA 1.49 2.271 0 CA-C-O 117.992 -1.449 . . . . 0.0 109.513 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.404 ' N ' ' HD2' ' A' ' 30' ' ' LYS . 0.7 OUTLIER -57.56 149.88 48.5 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.322 -0.861 . . . . 0.0 109.504 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.569 ' O ' ' N ' ' A' ' 33' ' ' SER . 48.4 Cg_endo -72.73 131.6 17.42 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.722 2.281 . . . . 0.0 112.141 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -62.65 69.74 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -0.886 . . . . 0.0 109.572 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.569 ' N ' ' O ' ' A' ' 31' ' ' PRO . 56.1 p -87.88 153.53 21.25 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 0.0 109.339 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.576 ' SG ' ' N ' ' A' ' 35' ' ' SER . 45.9 t -77.79 -177.72 5.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.268 -0.895 . . . . 0.0 109.617 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.576 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 35.6 t -91.26 -63.69 1.23 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.216 -0.927 . . . . 0.0 109.491 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.709 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 0.7 OUTLIER -109.62 91.32 3.6 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.151 -0.968 . . . . 0.0 109.58 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.709 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.5 p 150.81 94.34 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.493 -0.754 . . . . 0.0 109.134 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -47.05 75.92 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.719 2.279 . . . . 0.0 112.126 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.692 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 5.8 pt20 -148.89 146.14 27.77 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -0.877 . . . . 0.0 109.505 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -123.0 143.81 49.68 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.495 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.5 p -130.4 -169.98 2.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.293 -0.88 . . . . 0.0 109.504 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.02 -49.94 0.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.619 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.34 137.49 40.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.466 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.678 ' CD2' ' CG2' ' A' ' 48' ' ' THR . 2.3 t80 -45.17 -40.03 6.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.897 . . . . 0.0 109.432 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.0 -42.34 48.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.288 -0.883 . . . . 0.0 109.499 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.2 -32.92 22.4 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.241 -0.912 . . . . 0.0 109.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.3 ttp -74.77 -23.56 58.55 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.343 -0.848 . . . . 0.0 109.37 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.678 ' CG2' ' CD2' ' A' ' 44' ' ' PHE . 26.0 p -76.44 -50.48 13.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 53' ' ' THR . 18.3 mttt -51.55 -38.52 54.68 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.719 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.81 -47.03 71.27 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.52 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.482 HD22 ' N ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -72.87 -34.83 66.97 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.071 -1.018 . . . . 0.0 108.643 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.46 -15.21 60.44 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.668 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.7 OUTLIER -109.38 -0.51 18.98 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.57 -0.706 . . . . 0.0 109.214 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.458 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -41.37 -15.52 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.272 -0.893 . . . . 0.0 109.458 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.668 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.491 2.308 0 CA-C-O 117.994 -1.448 . . . . 0.0 109.537 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 121.335 0.588 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.29 149.51 98.05 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.3 -0.875 . . . . 0.0 109.531 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -72.62 141.6 34.7 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.843 2.362 . . . . 0.0 112.171 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 101.52 11.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.304 -0.873 . . . . 0.0 109.557 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.87 152.14 18.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.368 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.53 ' SG ' ' N ' ' A' ' 35' ' ' SER . 37.7 t -77.75 -176.25 4.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 109.543 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.53 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 48.4 t -91.78 -72.4 0.59 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.391 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 8.3 tt -102.79 91.76 4.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.682 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.4 p 151.66 92.1 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.615 -0.678 . . . . 0.0 109.206 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -46.53 79.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.721 2.281 . . . . 0.0 112.283 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 37' ' ' CYS . 10.6 pt20 -151.29 141.66 22.43 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 40' ' ' ARG . 7.9 mtp-105 -125.18 131.95 53.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.196 -0.94 . . . . 0.0 109.586 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.85 150.02 29.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.337 -0.852 . . . . 0.0 109.24 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -89.38 -19.31 25.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.184 -0.947 . . . . 0.0 109.543 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.3 144.5 34.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.246 -0.909 . . . . 0.0 109.435 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -58.03 -35.31 71.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.308 -0.87 . . . . 0.0 109.568 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.436 ' HG ' ' N ' ' A' ' 46' ' ' ALA . 2.6 p -49.42 -39.5 33.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.222 -0.924 . . . . 0.0 109.178 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.436 ' N ' ' HG ' ' A' ' 45' ' ' SER . . . -85.66 -27.75 25.17 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.291 -0.881 . . . . 0.0 109.07 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.5 ttt -70.09 -28.05 65.1 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.339 -0.85 . . . . 0.0 109.142 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.6 p -67.31 -51.47 52.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.204 -0.935 . . . . 0.0 109.155 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 53' ' ' THR . 11.1 mttt -53.33 -38.97 63.71 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.72 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.92 -42.05 68.36 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.602 -0.686 . . . . 0.0 109.168 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.433 HD23 ' CG ' ' A' ' 50' ' ' HIS . 0.3 OUTLIER -72.88 -39.97 65.98 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.048 -1.033 . . . . 0.0 108.844 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.411 ' HG2' ' NH1' ' A' ' 52' ' ' ARG . 5.2 tpp85 -73.08 -16.7 61.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.539 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -103.83 -5.49 22.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.448 -0.783 . . . . 0.0 109.091 179.671 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.539 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -34.15 149.0 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.483 -0.761 . . . . 0.0 109.631 -179.775 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 118.032 -1.427 . . . . 0.0 109.543 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.416 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 66.3 tt0 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.655 ' C ' ' H ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -72.74 113.96 26.04 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 109.418 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.416 ' HD3' ' O ' ' A' ' 29' ' ' GLU . 50.0 Cg_exo -49.39 5.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.577 2.184 . . . . 0.0 112.282 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.655 ' H ' ' C ' ' A' ' 30' ' ' LYS . 4.3 m-85 -110.34 69.25 0.69 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.241 -0.912 . . . . 0.0 109.665 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.526 ' H ' ' HG ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -105.9 158.71 16.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.227 -0.921 . . . . 0.0 109.3 179.831 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.617 ' SG ' ' N ' ' A' ' 35' ' ' SER . 51.3 t -73.02 -179.15 3.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.163 -0.961 . . . . 0.0 109.625 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.617 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.6 OUTLIER -89.65 -48.42 7.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.324 -0.86 . . . . 0.0 109.57 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.5 tp -127.47 91.47 3.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.221 -0.924 . . . . 0.0 109.614 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.69 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.6 p 150.01 134.64 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.592 -0.693 . . . . 0.0 109.146 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.4 76.61 3.1 Favored 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.703 2.269 . . . . 0.0 112.313 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 14.0 pt20 -151.54 142.75 23.27 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.187 -0.946 . . . . 0.0 109.424 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HD3' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -122.24 150.45 42.28 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.351 -0.843 . . . . 0.0 109.485 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.452 ' HG ' ' HB2' ' A' ' 47' ' ' MET . 24.1 p -125.9 -172.23 2.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 109.497 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -117.48 -59.53 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -112.98 163.41 14.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.273 -0.892 . . . . 0.0 109.413 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.462 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 18.3 t80 -62.16 -32.98 73.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.308 -0.87 . . . . 0.0 109.348 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.55 ' O ' ' OG1' ' A' ' 48' ' ' THR . 2.3 p -53.5 -45.2 69.59 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.293 -0.879 . . . . 0.0 109.419 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.78 -42.3 28.25 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -0.896 . . . . 0.0 109.4 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.452 ' HB2' ' HG ' ' A' ' 41' ' ' SER . 15.8 ttt -58.81 -27.38 65.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.412 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 45' ' ' SER . 7.9 p -68.25 -50.76 51.73 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.211 -0.93 . . . . 0.0 109.463 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 53' ' ' THR . 2.0 mtpt -52.68 -38.55 60.75 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.699 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.9 -43.7 77.52 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.674 -0.641 . . . . 0.0 109.287 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.419 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -70.82 -36.94 73.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.987 -1.071 . . . . 0.0 108.892 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -76.1 -23.28 54.95 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.562 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -94.76 -8.3 37.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.471 -0.768 . . . . 0.0 109.139 179.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.562 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -33.27 -53.56 0.39 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.342 -0.849 . . . . 0.0 109.512 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 CA-C-O 117.986 -1.452 . . . . 0.0 109.597 -179.985 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.595 ' CD ' ' H1 ' ' A' ' 29' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.07 149.46 73.8 Favored Pre-proline 0 N--CA 1.49 1.531 0 O-C-N 121.259 -0.901 . . . . 0.0 109.38 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -67.59 149.05 79.39 Favored 'Trans proline' 0 C--N 1.306 -1.706 0 C-N-CA 122.762 2.308 . . . . 0.0 111.985 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -124.21 134.44 53.27 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.629 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -92.65 165.68 12.86 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.313 -0.867 . . . . 0.0 109.212 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.746 ' SG ' ' N ' ' A' ' 35' ' ' SER . 35.6 t -74.51 -179.78 4.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.143 -0.973 . . . . 0.0 109.592 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.746 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -84.55 -44.38 13.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.341 -0.849 . . . . 0.0 109.712 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.685 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 6.1 tt -136.94 92.05 2.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.111 -0.993 . . . . 0.0 109.992 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.685 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.3 p 152.36 139.1 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.441 -0.787 . . . . 0.0 109.273 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.18 75.79 2.76 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.721 2.281 . . . . 0.0 112.255 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.695 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 7.3 pt20 -150.79 140.66 21.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.139 -0.975 . . . . 0.0 109.516 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HD2' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -128.71 153.63 47.14 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.211 -0.93 . . . . 0.0 109.473 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.41 162.83 33.44 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.205 -0.935 . . . . 0.0 109.49 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtp85 -103.07 -35.13 8.63 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.171 -0.956 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.38 140.77 52.64 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.257 -0.902 . . . . 0.0 109.443 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -47.71 -33.97 7.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.261 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.554 ' O ' ' OG1' ' A' ' 48' ' ' THR . 53.6 p -49.53 -55.53 13.05 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.897 . . . . 0.0 109.212 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.68 -28.55 63.8 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.301 -0.874 . . . . 0.0 109.185 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.452 ' O ' ' CD1' ' A' ' 51' ' ' LEU . 10.3 ttt -72.11 -25.48 61.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.277 -0.89 . . . . 0.0 109.255 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.554 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -72.0 -48.85 41.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.184 -0.947 . . . . 0.0 109.371 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 53' ' ' THR . 7.4 mmtp -51.89 -37.85 53.95 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.71 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.32 -48.47 65.4 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.452 ' CD1' ' O ' ' A' ' 47' ' ' MET . 7.3 mp -64.24 -38.96 92.93 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.009 -1.057 . . . . 0.0 108.618 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -73.84 -20.32 60.48 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.53 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -97.98 -9.43 26.14 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.466 -0.771 . . . . 0.0 109.114 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.53 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -34.96 -53.35 0.57 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 109.364 180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.973 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.6 pttm -130.28 150.55 76.47 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.234 -0.917 . . . . 0.0 109.456 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -42.75 117.93 1.03 Allowed 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.79 2.327 . . . . 0.0 112.287 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -69.5 126.1 28.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.295 -0.878 . . . . 0.0 109.431 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.93 156.49 23.9 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.25 -0.906 . . . . 0.0 109.536 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.71 ' SG ' ' N ' ' A' ' 35' ' ' SER . 35.1 t -73.83 178.81 4.61 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 109.512 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.71 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -70.26 -81.69 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.274 -0.891 . . . . 0.0 109.704 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.661 ' C ' ' SG ' ' A' ' 37' ' ' CYS . 33.7 tp -102.1 91.67 4.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.273 -0.892 . . . . 0.0 109.566 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.661 ' SG ' ' C ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER 156.82 94.16 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.413 -0.804 . . . . 0.0 109.283 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -47.93 79.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.726 2.284 . . . . 0.0 112.317 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.566 ' OE1' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -146.84 134.56 21.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.482 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.74 133.62 53.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.564 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.71 162.63 19.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.96 . . . . 0.0 109.441 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 43' ' ' ASP . 19.1 ttt-85 -118.59 -6.8 10.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.545 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.502 ' OD1' ' O ' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -146.4 163.28 36.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.198 -0.939 . . . . 0.0 109.487 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.441 ' CE2' HG22 ' A' ' 48' ' ' THR . 23.2 t80 -71.24 -39.99 71.31 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.581 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.7 OUTLIER -49.68 -55.58 13.28 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.293 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.95 -29.55 70.48 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.224 -0.923 . . . . 0.0 109.127 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.3 ttt -73.89 -32.5 63.62 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.392 -0.817 . . . . 0.0 109.334 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.581 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.8 OUTLIER -64.28 -53.05 55.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -0.9 . . . . 0.0 109.358 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 53' ' ' THR . 38.9 mttm -54.23 -37.81 65.02 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.19 -0.944 . . . . 0.0 108.486 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.706 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.81 -40.92 73.41 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.636 -0.665 . . . . 0.0 109.297 179.638 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.54 -37.61 68.25 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.04 -1.037 . . . . 0.0 108.917 179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -76.29 -22.64 54.8 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.568 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -93.59 -10.91 33.08 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.532 -0.73 . . . . 0.0 109.039 179.639 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.568 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -31.51 -83.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.399 -0.813 . . . . 0.0 109.645 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' A' ' 54' ' ' HIS . . . . . . . . 0 N--CA 1.489 2.21 0 CA-C-O 117.923 -1.487 . . . . 0.0 109.55 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 29' ' ' GLU . 25.2 mp0 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' O ' ' N ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -89.91 153.41 47.27 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.3 -0.875 . . . . 0.0 109.459 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -42.23 87.82 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.85 2.367 . . . . 0.0 112.148 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.456 ' N ' ' O ' ' A' ' 30' ' ' LYS . 1.6 m-85 -83.61 121.17 26.89 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.248 -0.908 . . . . 0.0 109.608 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.516 ' H ' ' HG ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -109.45 159.0 17.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.292 -0.88 . . . . 0.0 109.374 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.588 ' SG ' ' N ' ' A' ' 35' ' ' SER . 42.5 t -77.64 -178.62 5.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.547 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.588 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 91.7 p -85.86 -67.23 0.82 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.681 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 31.0 tp -111.56 92.8 4.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.675 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.681 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.3 p 152.59 97.13 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.483 -0.761 . . . . 0.0 109.315 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -48.02 76.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.657 2.238 . . . . 0.0 112.308 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.7 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 3.5 pt20 -151.54 141.44 22.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.245 -0.909 . . . . 0.0 109.461 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.3 mtt180 -117.18 162.54 17.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.263 -0.898 . . . . 0.0 109.725 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.558 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 6.5 p -145.0 150.72 37.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.292 -0.88 . . . . 0.0 109.494 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -90.18 -46.5 8.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 0.0 109.35 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.16 161.52 17.04 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.279 -0.888 . . . . 0.0 109.345 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -67.36 -34.05 76.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.588 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.6 t -49.71 -57.48 7.17 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.919 . . . . 0.0 109.201 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.74 -34.41 77.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.866 . . . . 0.0 109.142 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.558 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 2.7 ttt -69.26 -29.4 67.29 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.32 -0.863 . . . . 0.0 109.433 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.588 ' OG1' ' O ' ' A' ' 45' ' ' SER . 38.1 p -69.66 -49.17 56.18 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.209 -0.932 . . . . 0.0 109.408 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.564 ' H ' ' HG1' ' A' ' 48' ' ' THR . 9.0 mttm -51.79 -40.08 59.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.7 ' CG ' ' OE1' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -52.32 -49.0 65.12 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.467 ' N ' HD11 ' A' ' 51' ' ' LEU . 9.9 mp -56.42 -46.8 80.05 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.151 -0.968 . . . . 0.0 108.756 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.18 -18.24 62.49 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.664 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -98.75 -5.26 31.7 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.443 -0.785 . . . . 0.0 109.065 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -32.92 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.366 -0.834 . . . . 0.0 109.365 -179.846 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.664 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.414 ' CD ' ' H3 ' ' A' ' 29' ' ' GLU . 2.4 mp0 . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.47 149.77 47.4 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.867 . . . . 0.0 109.403 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -68.69 130.87 21.52 Favored 'Trans proline' 0 C--N 1.304 -1.775 0 C-N-CA 122.831 2.354 . . . . 0.0 112.055 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -57.45 115.52 2.79 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.312 -0.867 . . . . 0.0 109.626 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -79.31 170.24 16.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.34 -0.85 . . . . 0.0 109.362 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.757 ' SG ' ' N ' ' A' ' 35' ' ' SER . 19.6 t -81.07 179.02 8.05 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.723 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.757 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -78.79 -51.53 9.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.344 -0.847 . . . . 0.0 109.711 -179.872 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.713 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 4.5 tt -136.86 99.04 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.115 -0.991 . . . . 0.0 109.76 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.713 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.7 p 148.34 143.76 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.618 -0.676 . . . . 0.0 109.199 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -74.86 74.3 3.97 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.654 2.236 . . . . 0.0 112.34 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.665 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 6.1 pt20 -152.88 148.99 27.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -136.01 148.1 48.26 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.179 -0.951 . . . . 0.0 109.658 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 p -128.31 164.95 21.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 109.486 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.83 -46.87 4.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.168 -0.958 . . . . 0.0 109.379 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -112.88 159.49 18.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.365 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.734 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 22.7 t80 -59.63 -36.75 76.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.576 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.5 OUTLIER -49.72 -58.85 4.51 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 109.35 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.65 -33.21 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -28.62 63.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.314 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.734 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 1.6 p -71.13 -52.09 21.27 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -0.913 . . . . 0.0 109.451 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 53' ' ' THR . 13.6 mttt -52.04 -40.03 60.47 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.131 -0.981 . . . . 0.0 108.379 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.701 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.41 -43.9 65.06 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.692 -0.63 . . . . 0.0 109.309 179.587 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 54' ' ' HIS . 0.4 OUTLIER -67.93 -40.3 83.35 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.09 -1.007 . . . . 0.0 108.727 179.869 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -72.87 -19.2 61.34 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.447 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -100.67 -4.27 28.65 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -40.18 147.49 0.1 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.373 -0.829 . . . . 0.0 109.489 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 CA-C-O 117.969 -1.462 . . . . 0.0 109.475 179.877 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.301 0.572 . . . . 0.0 109.487 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -102.9 152.05 38.45 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.206 -0.934 . . . . 0.0 109.5 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -40.99 132.94 2.8 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 122.798 2.332 . . . . 0.0 112.219 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.73 110.07 14.48 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.218 -0.926 . . . . 0.0 109.667 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.7 152.43 26.55 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.333 -0.854 . . . . 0.0 109.114 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 35' ' ' SER . 38.2 t -76.11 -179.18 4.82 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.072 -1.018 . . . . 0.0 109.636 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.508 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 18.2 m -82.87 -89.16 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 0.0 109.486 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.663 ' C ' ' SG ' ' A' ' 37' ' ' CYS . 7.4 tt -91.25 91.12 8.05 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.169 -0.957 . . . . 0.0 109.106 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.663 ' SG ' ' C ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER 158.55 91.81 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.501 -0.749 . . . . 0.0 109.088 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -46.8 79.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.95 2.433 . . . . 0.0 112.475 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -148.93 136.55 20.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.195 -0.94 . . . . 0.0 109.552 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -127.62 126.84 42.77 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.285 -0.884 . . . . 0.0 109.38 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.681 ' HG ' ' N ' ' A' ' 42' ' ' ARG . 1.4 p -116.06 -167.2 1.23 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.949 . . . . 0.0 109.715 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.681 ' N ' ' HG ' ' A' ' 41' ' ' SER . 36.8 mmt-85 -128.0 -47.17 1.37 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -0.856 . . . . 0.0 109.319 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.74 174.07 6.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.34 -0.85 . . . . 0.0 109.293 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.457 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.4 OUTLIER -75.05 -33.82 61.78 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.0 109.495 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 m -52.22 -43.37 64.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.261 -0.9 . . . . 0.0 109.484 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.98 -35.03 20.67 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.364 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.646 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 1.8 tpt -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.222 -0.924 . . . . 0.0 109.398 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.457 ' OG1' ' O ' ' A' ' 44' ' ' PHE . 1.4 p -69.05 -46.05 68.85 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.223 -0.923 . . . . 0.0 109.41 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.4 mttt -53.01 -38.66 62.54 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.755 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.42 -45.9 69.56 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.569 -0.707 . . . . 0.0 109.348 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.453 ' N ' ' CD1' ' A' ' 51' ' ' LEU . 7.1 mp -66.46 -39.59 88.91 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.046 -1.034 . . . . 0.0 108.873 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -74.65 -19.33 60.32 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.374 -0.828 . . . . 0.0 108.844 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.56 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -96.61 -12.04 24.49 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.413 -0.804 . . . . 0.0 109.01 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.56 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -31.18 -41.23 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.501 -0.749 . . . . 0.0 109.511 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.491 2.315 0 CA-C-O 117.97 -1.461 . . . . 0.0 109.512 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -49.52 143.92 9.83 Favored Pre-proline 0 N--CA 1.49 1.539 0 O-C-N 121.276 -0.89 . . . . 0.0 109.42 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.81 151.96 52.0 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.781 2.32 . . . . 0.0 112.197 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -149.14 165.83 30.61 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.263 -0.898 . . . . 0.0 109.5 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.73 158.4 23.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.258 -0.902 . . . . 0.0 109.431 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.589 ' SG ' ' N ' ' A' ' 35' ' ' SER . 42.7 t -69.79 -176.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.397 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.77 -65.03 1.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.881 . . . . 0.0 109.457 -179.927 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.668 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 60.3 tp -114.79 91.82 3.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.248 -0.908 . . . . 0.0 109.514 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.668 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 0.9 OUTLIER 154.72 101.27 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.364 -0.835 . . . . 0.0 109.323 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -47.99 72.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.633 0 C-N-CA 122.676 2.251 . . . . 0.0 112.212 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -140.17 147.74 40.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.421 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -121.52 145.19 48.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.22 -0.925 . . . . 0.0 109.599 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.51 140.15 42.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.315 -0.866 . . . . 0.0 109.39 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.495 ' CG ' ' N ' ' A' ' 43' ' ' ASP . 5.9 ptp180 -95.97 -42.45 8.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.254 -0.904 . . . . 0.0 109.561 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.495 ' N ' ' CG ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -115.07 161.8 17.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.926 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 32.1 t80 -65.42 -33.37 75.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.886 . . . . 0.0 109.283 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.453 ' O ' ' OG1' ' A' ' 48' ' ' THR . 5.7 m -50.04 -50.91 46.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.348 -0.845 . . . . 0.0 109.37 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.57 -28.06 58.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.241 -0.912 . . . . 0.0 109.398 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.447 ' O ' ' CD2' ' A' ' 51' ' ' LEU . 8.0 ttt -72.22 -22.53 61.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.284 -0.885 . . . . 0.0 109.339 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.574 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -77.09 -53.31 7.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.209 -0.932 . . . . 0.0 109.536 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 53' ' ' THR . 32.3 mttt -52.06 -38.59 57.61 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.166 -0.959 . . . . 0.0 108.48 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.699 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.45 -43.86 75.81 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.606 -0.684 . . . . 0.0 109.282 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.452 ' N ' HD21 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -73.43 -32.25 64.29 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.068 -1.02 . . . . 0.0 109.01 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.52 -31.08 53.22 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.669 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.8 OUTLIER -84.35 -15.04 47.88 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.497 -0.752 . . . . 0.0 109.128 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.504 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -35.3 89.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 109.469 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.669 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.489 2.219 0 CA-C-O 118.027 -1.43 . . . . 0.0 109.594 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.414 ' O ' ' C ' ' A' ' 30' ' ' LYS . 4.7 mt-10 . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.486 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 6.5 pttp -44.38 152.86 0.48 Allowed Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.293 -0.88 . . . . 0.0 109.36 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -43.36 155.17 0.16 Allowed 'Trans proline' 0 C--N 1.307 -1.633 0 C-N-CA 122.734 2.289 . . . . 0.0 112.044 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.486 ' CD1' ' O ' ' A' ' 30' ' ' LYS . 27.1 m-85 -131.07 82.96 2.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.266 -0.896 . . . . 0.0 109.441 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.85 161.38 18.34 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.342 -0.849 . . . . 0.0 109.49 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.718 ' SG ' ' N ' ' A' ' 35' ' ' SER . 35.5 t -72.62 179.74 3.42 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.221 -0.924 . . . . 0.0 109.346 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.718 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -82.91 -43.09 16.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.159 -0.963 . . . . 0.0 109.751 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.0 OUTLIER -137.08 91.86 2.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.0 110.051 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.69 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.2 p 153.14 137.52 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.437 -0.789 . . . . 0.0 109.527 179.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.88 71.92 2.67 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.756 2.304 . . . . 0.0 112.209 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.851 HE21 ' CD2' ' A' ' 50' ' ' HIS . 9.2 pt20 -153.43 163.26 40.25 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.25 -0.906 . . . . 0.0 109.349 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -140.8 146.81 38.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.247 -0.908 . . . . 0.0 109.683 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.64 159.18 32.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.32 -0.862 . . . . 0.0 109.471 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.477 HH11 ' HD2' ' A' ' 42' ' ' ARG . 24.4 mtm105 -90.17 -72.77 0.55 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.25 153.63 19.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.537 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.476 ' CD2' ' CG2' ' A' ' 48' ' ' THR . 7.0 t80 -58.72 -35.56 72.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.0 109.32 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -44.8 45.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 109.141 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.48 -33.12 48.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.357 -0.839 . . . . 0.0 109.097 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.12 63.51 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.313 -0.867 . . . . 0.0 109.255 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.476 ' CG2' ' CD2' ' A' ' 44' ' ' PHE . 3.4 p -70.59 -52.18 23.26 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.877 . . . . 0.0 109.309 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -51.99 -39.06 58.81 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.851 ' CD2' HE21 ' A' ' 39' ' ' GLN . 0.0 OUTLIER -51.9 -44.5 63.82 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 54' ' ' HIS . 1.9 mt -61.28 -45.53 94.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.141 -0.974 . . . . 0.0 108.931 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -71.08 -19.51 62.46 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.582 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.4 OUTLIER -100.01 -5.0 28.81 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.582 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -31.1 -51.73 0.18 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 109.636 -179.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 CA-C-O 118.041 -1.422 . . . . 0.0 109.567 179.962 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.81 167.96 10.78 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.274 -0.891 . . . . 0.0 109.457 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.757 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 45.3 t -82.92 -176.85 6.53 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.58 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 68.2 m -90.73 -64.3 1.15 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.239 -0.913 . . . . 0.0 109.516 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.692 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.5 tt -110.66 91.37 3.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.155 -0.965 . . . . 0.0 109.477 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.74 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.6 p 150.71 129.9 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.511 -0.743 . . . . 0.0 109.163 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.43 69.65 4.16 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.591 2.194 . . . . 0.0 112.165 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.44 ' OE1' ' NE2' ' A' ' 50' ' ' HIS . 7.3 pt20 -144.81 165.1 29.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.216 -0.927 . . . . 0.0 109.59 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 mtt180 -142.56 153.65 43.74 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.25 -0.906 . . . . 0.0 109.408 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 p -125.44 158.11 35.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -96.52 -22.88 16.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.223 -0.923 . . . . 0.0 109.567 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.54 140.33 27.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.51 ' O ' HG23 ' A' ' 48' ' ' THR . 3.0 t80 -47.7 -32.95 6.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.58 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.0 OUTLIER -50.07 -53.6 26.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.462 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.18 -38.06 63.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.333 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.2 ttt -58.79 -30.76 67.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.247 -0.908 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.58 ' OG1' ' O ' ' A' ' 45' ' ' SER . 18.0 p -67.26 -53.26 31.55 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.443 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 53' ' ' THR . 8.8 mtpp -52.07 -40.9 61.87 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.137 -0.977 . . . . 0.0 108.365 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.757 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.13 -42.35 63.26 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.689 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.484 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -71.0 -44.31 66.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.998 -1.064 . . . . 0.0 108.97 179.817 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 mtm-85 -68.79 -15.91 63.64 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.911 . . . . 0.0 108.72 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.52 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -104.06 -6.49 21.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.462 -0.774 . . . . 0.0 109.297 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.52 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.366 -0.834 . . . . 0.0 109.416 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 121.312 0.577 . . . . 0.0 109.506 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.45 154.7 23.26 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 109.447 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.761 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 49.5 t -78.83 -177.81 5.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.238 -0.914 . . . . 0.0 109.626 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.61 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 1.8 t -84.85 -82.68 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.262 -0.899 . . . . 0.0 109.529 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.675 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 3.8 tt -93.22 90.81 6.98 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.285 -0.884 . . . . 0.0 109.291 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.759 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.1 p 153.68 86.3 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -45.05 78.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.818 2.346 . . . . 0.0 112.342 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.695 HE21 ' C ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -145.32 138.85 26.64 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.194 -0.941 . . . . 0.0 109.442 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.676 ' N ' ' CD ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.81 135.06 53.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.278 -0.889 . . . . 0.0 109.462 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -140.48 147.59 39.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 109.506 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.19 -6.04 17.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.305 -0.872 . . . . 0.0 109.494 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.13 135.06 51.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 109.518 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.512 ' O ' ' N ' ' A' ' 48' ' ' THR . 4.9 t80 -50.16 -39.04 42.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.449 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.505 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.5 t -49.64 -59.94 3.33 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 109.254 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -26.67 68.62 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.197 -0.94 . . . . 0.0 109.194 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.4 ttp -80.18 -27.47 38.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.306 -0.871 . . . . 0.0 109.354 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.512 ' N ' ' O ' ' A' ' 44' ' ' PHE . 0.8 OUTLIER -70.43 -54.92 10.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.237 -0.914 . . . . 0.0 109.432 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 21.5 mttt -52.39 -36.4 53.98 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.761 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.14 -43.61 74.32 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.491 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.608 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.04 -33.5 68.05 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.092 -1.005 . . . . 0.0 108.799 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -79.9 -23.4 41.86 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -92.63 -10.28 37.96 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.077 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.441 -0.787 . . . . 0.0 109.595 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 121.254 0.55 . . . . 0.0 109.585 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.32 153.58 20.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.305 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.776 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 52.5 t -72.79 179.47 3.63 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.158 -0.964 . . . . 0.0 109.62 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.634 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 3.9 m -80.52 -74.48 0.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.241 -0.912 . . . . 0.0 109.849 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.674 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.8 tp -103.6 91.5 4.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.208 -0.932 . . . . 0.0 109.617 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.758 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.9 OUTLIER 154.54 93.58 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.372 -0.83 . . . . 0.0 109.255 179.778 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -48.39 79.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.748 2.299 . . . . 0.0 112.318 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 1.9 pt20 -153.36 142.48 21.37 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.293 -0.879 . . . . 0.0 109.546 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.74 140.47 48.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.451 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.41 172.27 8.46 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.131 -0.981 . . . . 0.0 109.479 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.36 -65.53 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.0 109.527 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -96.11 -179.36 4.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.115 -0.991 . . . . 0.0 109.61 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 48' ' ' THR . 3.5 t80 -79.03 -37.32 39.4 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.227 -0.921 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.48 ' O ' ' OG1' ' A' ' 48' ' ' THR . 38.9 t -49.61 -50.35 43.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.196 -0.94 . . . . 0.0 109.197 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.37 -38.85 74.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.14 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.9 ttt -66.97 -31.84 72.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.346 -0.846 . . . . 0.0 109.278 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -66.3 -51.86 53.1 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.337 -0.852 . . . . 0.0 109.356 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.446 ' O ' ' N ' ' A' ' 53' ' ' THR . 37.6 mmtt -52.43 -41.39 63.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.776 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.2 -42.46 63.54 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.603 -0.686 . . . . 0.0 109.253 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.541 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -73.21 -40.53 64.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.976 -1.078 . . . . 0.0 108.906 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -71.32 -16.82 62.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.292 -0.88 . . . . 0.0 108.664 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.447 HG22 ' O ' ' A' ' 50' ' ' HIS . 0.6 OUTLIER -101.85 -5.83 24.31 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.515 -0.74 . . . . 0.0 109.167 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.442 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.349 -0.845 . . . . 0.0 109.503 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.23 0.538 . . . . 0.0 109.577 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.21 170.42 7.92 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.165 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.825 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 50.0 t -75.8 -179.39 4.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.0 109.603 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.619 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER -87.34 -70.57 0.61 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.283 -0.886 . . . . 0.0 109.778 -179.699 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 37.6 tp -110.08 91.77 3.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.17 -0.956 . . . . 0.0 109.925 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.801 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.2 p 152.93 103.45 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.427 -0.795 . . . . 0.0 109.175 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.3 79.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 122.621 2.214 . . . . 0.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.9 OUTLIER -145.14 140.57 28.08 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.277 -0.89 . . . . 0.0 109.483 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -119.83 140.18 51.21 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.325 -0.859 . . . . 0.0 109.25 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 32.9 p -141.36 167.64 21.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.139 -0.975 . . . . 0.0 109.592 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -129.97 -49.21 1.12 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 0.0 109.289 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -98.41 140.8 32.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.874 . . . . 0.0 109.273 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 48' ' ' THR . 4.3 t80 -52.93 -27.95 21.24 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.162 -0.961 . . . . 0.0 109.557 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.4 OUTLIER -57.8 -43.18 85.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.267 -0.895 . . . . 0.0 109.361 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.95 -36.21 31.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 109.389 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 ttm -68.32 -23.64 64.75 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.245 -0.909 . . . . 0.0 109.354 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.524 HG23 ' O ' ' A' ' 44' ' ' PHE . 4.3 p -71.98 -53.62 12.43 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.239 -0.913 . . . . 0.0 109.312 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.1 mmmt -51.79 -36.57 48.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.825 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -53.53 -46.4 70.14 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.47 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -66.99 -34.71 78.35 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.059 -1.025 . . . . 0.0 108.574 179.744 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -78.58 -22.06 47.68 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -90.24 -13.73 34.82 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.499 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.449 -0.782 . . . . 0.0 109.457 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 81.6 p -107.52 163.95 12.63 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.226 -0.921 . . . . 0.0 109.406 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.763 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 29.5 t -83.52 -178.07 6.92 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.25 -0.906 . . . . 0.0 109.603 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.491 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.2 OUTLIER -88.55 -77.29 0.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.242 -0.911 . . . . 0.0 109.519 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.663 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 26.4 tp -100.18 91.2 4.64 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.212 -0.93 . . . . 0.0 109.263 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.756 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.9 OUTLIER 154.96 93.23 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 109.151 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.39 79.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.806 2.338 . . . . 0.0 112.386 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.639 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 7.1 pt20 -156.15 154.52 31.0 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.127 -0.983 . . . . 0.0 109.628 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 mtm-85 -132.88 154.31 50.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.318 -0.864 . . . . 0.0 109.485 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -130.44 177.42 7.37 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.18 -0.95 . . . . 0.0 109.461 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -126.19 -46.49 1.65 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.392 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.505 ' O ' ' C ' ' A' ' 44' ' ' PHE . 0.4 OUTLIER -116.12 136.03 53.39 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.335 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.505 ' C ' ' O ' ' A' ' 43' ' ' ASP . 6.5 t80 -38.19 -35.55 0.17 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.179 -0.951 . . . . 0.0 109.438 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.45 ' OG ' ' N ' ' A' ' 46' ' ' ALA . 18.2 p -50.81 -57.26 8.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.229 -0.919 . . . . 0.0 109.415 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.45 ' N ' ' OG ' ' A' ' 45' ' ' SER . . . -68.03 -33.82 75.31 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.316 -0.865 . . . . 0.0 109.42 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -37.91 87.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.447 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.464 HG23 ' CE2' ' A' ' 44' ' ' PHE . 0.1 OUTLIER -63.93 -50.27 69.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.555 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 53' ' ' THR . 17.9 mttt -52.95 -42.83 65.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.082 -1.011 . . . . 0.0 108.428 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.763 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.81 -43.02 65.64 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.63 -0.669 . . . . 0.0 109.31 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -73.26 -38.22 66.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.039 -1.038 . . . . 0.0 108.992 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -74.03 -17.75 60.93 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.264 -0.897 . . . . 0.0 108.643 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.549 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -101.33 -8.97 21.6 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.447 -0.783 . . . . 0.0 109.092 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.549 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.467 -0.771 . . . . 0.0 109.475 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 56.1 p -87.88 153.53 21.25 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 0.0 109.339 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.76 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 45.9 t -77.79 -177.72 5.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.268 -0.895 . . . . 0.0 109.617 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.576 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 35.6 t -91.26 -63.69 1.23 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.216 -0.927 . . . . 0.0 109.491 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.709 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 0.7 OUTLIER -109.62 91.32 3.6 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.151 -0.968 . . . . 0.0 109.58 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.758 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.5 p 150.81 94.34 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.493 -0.754 . . . . 0.0 109.134 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -47.05 75.92 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.719 2.279 . . . . 0.0 112.126 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.692 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 5.8 pt20 -148.89 146.14 27.77 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -0.877 . . . . 0.0 109.505 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -123.0 143.81 49.68 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.495 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.5 p -130.4 -169.98 2.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.293 -0.88 . . . . 0.0 109.504 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.02 -49.94 0.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.619 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.34 137.49 40.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.466 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.678 ' CD2' ' CG2' ' A' ' 48' ' ' THR . 2.3 t80 -45.17 -40.03 6.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.897 . . . . 0.0 109.432 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.0 -42.34 48.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.288 -0.883 . . . . 0.0 109.499 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.2 -32.92 22.4 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.241 -0.912 . . . . 0.0 109.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.3 ttp -74.77 -23.56 58.55 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.343 -0.848 . . . . 0.0 109.37 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.678 ' CG2' ' CD2' ' A' ' 44' ' ' PHE . 26.0 p -76.44 -50.48 13.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 53' ' ' THR . 18.3 mttt -51.55 -38.52 54.68 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.76 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -53.81 -47.03 71.27 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.52 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.491 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -72.87 -34.83 66.97 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.071 -1.018 . . . . 0.0 108.643 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.46 -15.21 60.44 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.524 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -109.38 -0.51 18.98 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.57 -0.706 . . . . 0.0 109.214 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.458 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.272 -0.893 . . . . 0.0 109.458 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.87 152.14 18.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.368 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.752 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 37.7 t -77.75 -176.25 4.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 109.543 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.53 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 48.4 t -91.78 -72.4 0.59 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.391 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 8.3 tt -102.79 91.76 4.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.752 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.4 p 151.66 92.1 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.615 -0.678 . . . . 0.0 109.206 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -46.53 79.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.721 2.281 . . . . 0.0 112.283 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 37' ' ' CYS . 10.6 pt20 -151.29 141.66 22.43 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.435 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 7.9 mtp-105 -125.18 131.95 53.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.196 -0.94 . . . . 0.0 109.586 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.85 150.02 29.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.337 -0.852 . . . . 0.0 109.24 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -89.38 -19.31 25.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.184 -0.947 . . . . 0.0 109.543 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.3 144.5 34.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.246 -0.909 . . . . 0.0 109.435 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -58.03 -35.31 71.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.308 -0.87 . . . . 0.0 109.568 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.6 p -49.42 -39.5 33.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.222 -0.924 . . . . 0.0 109.178 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.66 -27.75 25.17 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.291 -0.881 . . . . 0.0 109.07 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.5 ttt -70.09 -28.05 65.1 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.339 -0.85 . . . . 0.0 109.142 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.6 p -67.31 -51.47 52.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.204 -0.935 . . . . 0.0 109.155 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 53' ' ' THR . 11.1 mttt -53.33 -38.97 63.71 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.72 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.92 -42.05 68.36 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.602 -0.686 . . . . 0.0 109.168 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.575 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -72.88 -39.97 65.98 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.048 -1.033 . . . . 0.0 108.844 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.407 ' HG2' ' NH1' ' A' ' 52' ' ' ARG . 5.2 tpp85 -73.08 -16.7 61.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.539 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -103.83 -5.49 22.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.448 -0.783 . . . . 0.0 109.091 179.671 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.539 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.483 -0.761 . . . . 0.0 109.631 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.256 0.55 . . . . 0.0 109.665 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.9 158.71 16.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.227 -0.921 . . . . 0.0 109.3 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.788 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 51.3 t -73.02 -179.15 3.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.163 -0.961 . . . . 0.0 109.625 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.617 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.6 OUTLIER -89.65 -48.42 7.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.324 -0.86 . . . . 0.0 109.57 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.5 tp -127.47 91.47 3.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.221 -0.924 . . . . 0.0 109.614 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.775 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.6 p 150.01 134.64 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.592 -0.693 . . . . 0.0 109.146 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.4 76.61 3.1 Favored 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.703 2.269 . . . . 0.0 112.313 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 14.0 pt20 -151.54 142.75 23.27 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.187 -0.946 . . . . 0.0 109.424 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.564 ' HD3' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -122.24 150.45 42.28 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.351 -0.843 . . . . 0.0 109.485 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 p -125.9 -172.23 2.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 109.497 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -117.48 -59.53 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -112.98 163.41 14.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.273 -0.892 . . . . 0.0 109.413 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.511 ' O ' HG23 ' A' ' 48' ' ' THR . 18.3 t80 -62.16 -32.98 73.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.308 -0.87 . . . . 0.0 109.348 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.55 ' O ' ' OG1' ' A' ' 48' ' ' THR . 2.3 p -53.5 -45.2 69.59 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.293 -0.879 . . . . 0.0 109.419 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.78 -42.3 28.25 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -0.896 . . . . 0.0 109.4 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.8 ttt -58.81 -27.38 65.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.412 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 45' ' ' SER . 7.9 p -68.25 -50.76 51.73 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.211 -0.93 . . . . 0.0 109.463 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 53' ' ' THR . 2.0 mtpt -52.68 -38.55 60.75 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.788 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.9 -43.7 77.52 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.674 -0.641 . . . . 0.0 109.287 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.58 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -70.82 -36.94 73.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.987 -1.071 . . . . 0.0 108.892 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -76.1 -23.28 54.95 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.562 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -94.76 -8.3 37.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.471 -0.768 . . . . 0.0 109.139 179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.562 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.342 -0.849 . . . . 0.0 109.512 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.315 0.579 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -92.65 165.68 12.86 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.313 -0.867 . . . . 0.0 109.212 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.832 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 35.6 t -74.51 -179.78 4.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.143 -0.973 . . . . 0.0 109.592 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.746 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -84.55 -44.38 13.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.341 -0.849 . . . . 0.0 109.712 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.685 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 6.1 tt -136.94 92.05 2.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.111 -0.993 . . . . 0.0 109.992 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.805 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.3 p 152.36 139.1 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.441 -0.787 . . . . 0.0 109.273 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.18 75.79 2.76 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.721 2.281 . . . . 0.0 112.255 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.695 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 7.3 pt20 -150.79 140.66 21.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.139 -0.975 . . . . 0.0 109.516 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.519 ' HD2' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -128.71 153.63 47.14 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.211 -0.93 . . . . 0.0 109.473 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.41 162.83 33.44 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.205 -0.935 . . . . 0.0 109.49 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtp85 -103.07 -35.13 8.63 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.171 -0.956 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.38 140.77 52.64 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.257 -0.902 . . . . 0.0 109.443 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -47.71 -33.97 7.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.261 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.552 ' O ' ' OG1' ' A' ' 48' ' ' THR . 53.6 p -49.53 -55.53 13.05 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.897 . . . . 0.0 109.212 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.68 -28.55 63.8 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.301 -0.874 . . . . 0.0 109.185 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.452 ' O ' ' CD1' ' A' ' 51' ' ' LEU . 10.3 ttt -72.11 -25.48 61.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.277 -0.89 . . . . 0.0 109.255 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.552 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -72.0 -48.85 41.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.184 -0.947 . . . . 0.0 109.371 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 53' ' ' THR . 7.4 mmtp -51.89 -37.85 53.95 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.832 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.32 -48.47 65.4 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.668 HD12 ' N ' ' A' ' 51' ' ' LEU . 7.3 mp -64.24 -38.96 92.93 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.009 -1.057 . . . . 0.0 108.618 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -73.84 -20.32 60.48 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.53 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -97.98 -9.43 26.14 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.466 -0.771 . . . . 0.0 109.114 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.53 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 109.364 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.93 156.49 23.9 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.25 -0.906 . . . . 0.0 109.536 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.773 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 35.1 t -73.83 178.81 4.61 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 109.512 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.71 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -70.26 -81.69 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.274 -0.891 . . . . 0.0 109.704 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.661 ' C ' ' SG ' ' A' ' 37' ' ' CYS . 33.7 tp -102.1 91.67 4.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.273 -0.892 . . . . 0.0 109.566 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.744 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER 156.82 94.16 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.413 -0.804 . . . . 0.0 109.283 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -47.93 79.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.726 2.284 . . . . 0.0 112.317 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.566 ' O ' ' OE1' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -146.84 134.56 21.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.482 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.74 133.62 53.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.564 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.71 162.63 19.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.96 . . . . 0.0 109.441 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 43' ' ' ASP . 19.1 ttt-85 -118.59 -6.8 10.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.545 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.502 ' OD1' ' O ' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -146.4 163.28 36.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.198 -0.939 . . . . 0.0 109.487 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.455 ' CE2' HG23 ' A' ' 48' ' ' THR . 23.2 t80 -71.24 -39.99 71.31 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.577 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.7 OUTLIER -49.68 -55.58 13.28 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.293 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.95 -29.55 70.48 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.224 -0.923 . . . . 0.0 109.127 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.3 ttt -73.89 -32.5 63.62 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.392 -0.817 . . . . 0.0 109.334 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.577 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.8 OUTLIER -64.28 -53.05 55.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -0.9 . . . . 0.0 109.358 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 53' ' ' THR . 38.9 mttm -54.23 -37.81 65.02 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.19 -0.944 . . . . 0.0 108.486 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.773 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.81 -40.92 73.41 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.636 -0.665 . . . . 0.0 109.297 179.638 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.571 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.54 -37.61 68.25 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.04 -1.037 . . . . 0.0 108.917 179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -76.29 -22.64 54.8 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.568 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -93.59 -10.91 33.08 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.532 -0.73 . . . . 0.0 109.039 179.639 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.568 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.399 -0.813 . . . . 0.0 109.645 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.267 0.556 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.45 159.0 17.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.292 -0.88 . . . . 0.0 109.374 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.789 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 42.5 t -77.64 -178.62 5.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.547 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.588 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 91.7 p -85.86 -67.23 0.82 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.681 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 31.0 tp -111.56 92.8 4.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.675 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.756 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.3 p 152.59 97.13 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.483 -0.761 . . . . 0.0 109.315 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -48.02 76.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.657 2.238 . . . . 0.0 112.308 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.7 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 3.5 pt20 -151.54 141.44 22.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.245 -0.909 . . . . 0.0 109.461 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.3 mtt180 -117.18 162.54 17.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.263 -0.898 . . . . 0.0 109.725 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.558 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 6.5 p -145.0 150.72 37.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.292 -0.88 . . . . 0.0 109.494 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -90.18 -46.5 8.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 0.0 109.35 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.16 161.52 17.04 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.279 -0.888 . . . . 0.0 109.345 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' O ' HG23 ' A' ' 48' ' ' THR . 6.2 t80 -67.36 -34.05 76.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.575 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.6 t -49.71 -57.48 7.17 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.919 . . . . 0.0 109.201 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.74 -34.41 77.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.866 . . . . 0.0 109.142 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.558 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 2.7 ttt -69.26 -29.4 67.29 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.32 -0.863 . . . . 0.0 109.433 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.618 HG23 ' O ' ' A' ' 44' ' ' PHE . 38.1 p -69.66 -49.17 56.18 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.209 -0.932 . . . . 0.0 109.408 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' N ' ' A' ' 53' ' ' THR . 9.0 mttm -51.79 -40.08 59.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.789 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.32 -49.0 65.12 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 51' ' ' LEU . 9.9 mp -56.42 -46.8 80.05 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.151 -0.968 . . . . 0.0 108.756 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.18 -18.24 62.49 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.558 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -98.75 -5.26 31.7 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.443 -0.785 . . . . 0.0 109.065 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.366 -0.834 . . . . 0.0 109.365 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.247 0.546 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -79.31 170.24 16.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.34 -0.85 . . . . 0.0 109.362 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.798 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 19.6 t -81.07 179.02 8.05 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.723 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.757 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -78.79 -51.53 9.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.344 -0.847 . . . . 0.0 109.711 -179.872 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.713 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 4.5 tt -136.86 99.04 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.115 -0.991 . . . . 0.0 109.76 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.79 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.7 p 148.34 143.76 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.618 -0.676 . . . . 0.0 109.199 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -74.86 74.3 3.97 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.654 2.236 . . . . 0.0 112.34 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.665 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 6.1 pt20 -152.88 148.99 27.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -136.01 148.1 48.26 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.179 -0.951 . . . . 0.0 109.658 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 p -128.31 164.95 21.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 109.486 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.83 -46.87 4.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.168 -0.958 . . . . 0.0 109.379 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -112.88 159.49 18.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.365 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.734 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 22.7 t80 -59.63 -36.75 76.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.569 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.5 OUTLIER -49.72 -58.85 4.51 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 109.35 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.65 -33.21 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -28.62 63.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.314 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.734 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 1.6 p -71.13 -52.09 21.27 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -0.913 . . . . 0.0 109.451 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 53' ' ' THR . 13.6 mttt -52.04 -40.03 60.47 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.131 -0.981 . . . . 0.0 108.379 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.798 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.41 -43.9 65.06 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.692 -0.63 . . . . 0.0 109.309 179.587 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.506 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.4 OUTLIER -67.93 -40.3 83.35 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.09 -1.007 . . . . 0.0 108.727 179.869 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -72.87 -19.2 61.34 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.447 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -100.67 -4.27 28.65 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.373 -0.829 . . . . 0.0 109.489 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.296 0.57 . . . . 0.0 109.667 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.7 152.43 26.55 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.333 -0.854 . . . . 0.0 109.114 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.767 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 38.2 t -76.11 -179.18 4.82 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.072 -1.018 . . . . 0.0 109.636 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.508 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 18.2 m -82.87 -89.16 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 0.0 109.486 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.673 ' C ' HD23 ' A' ' 36' ' ' LEU . 7.4 tt -91.25 91.12 8.05 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.169 -0.957 . . . . 0.0 109.106 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.751 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER 158.55 91.81 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.501 -0.749 . . . . 0.0 109.088 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -46.8 79.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.95 2.433 . . . . 0.0 112.475 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -148.93 136.55 20.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.195 -0.94 . . . . 0.0 109.552 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -127.62 126.84 42.77 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.285 -0.884 . . . . 0.0 109.38 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.607 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 1.4 p -116.06 -167.2 1.23 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.949 . . . . 0.0 109.715 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -128.0 -47.17 1.37 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -0.856 . . . . 0.0 109.319 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.74 174.07 6.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.34 -0.85 . . . . 0.0 109.293 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.528 ' CD2' HG23 ' A' ' 48' ' ' THR . 0.4 OUTLIER -75.05 -33.82 61.78 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.0 109.495 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 m -52.22 -43.37 64.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.261 -0.9 . . . . 0.0 109.484 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.98 -35.03 20.67 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.364 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.607 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 1.8 tpt -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.222 -0.924 . . . . 0.0 109.398 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 44' ' ' PHE . 1.4 p -69.05 -46.05 68.85 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.223 -0.923 . . . . 0.0 109.41 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.4 mttt -53.01 -38.66 62.54 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.767 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -53.42 -45.9 69.56 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.569 -0.707 . . . . 0.0 109.348 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.68 HD12 ' N ' ' A' ' 51' ' ' LEU . 7.1 mp -66.46 -39.59 88.91 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.046 -1.034 . . . . 0.0 108.873 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -74.65 -19.33 60.32 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.374 -0.828 . . . . 0.0 108.844 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.56 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -96.61 -12.04 24.49 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.413 -0.804 . . . . 0.0 109.01 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.56 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.501 -0.749 . . . . 0.0 109.511 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.73 158.4 23.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.258 -0.902 . . . . 0.0 109.431 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.776 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 42.7 t -69.79 -176.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.397 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.77 -65.03 1.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.881 . . . . 0.0 109.457 -179.927 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.668 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 60.3 tp -114.79 91.82 3.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.248 -0.908 . . . . 0.0 109.514 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.756 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.9 OUTLIER 154.72 101.27 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.364 -0.835 . . . . 0.0 109.323 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -47.99 72.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.633 0 C-N-CA 122.676 2.251 . . . . 0.0 112.212 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -140.17 147.74 40.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.421 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -121.52 145.19 48.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.22 -0.925 . . . . 0.0 109.599 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.51 140.15 42.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.315 -0.866 . . . . 0.0 109.39 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.495 ' CG ' ' N ' ' A' ' 43' ' ' ASP . 5.9 ptp180 -95.97 -42.45 8.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.254 -0.904 . . . . 0.0 109.561 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.495 ' N ' ' CG ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -115.07 161.8 17.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.926 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 32.1 t80 -65.42 -33.37 75.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.886 . . . . 0.0 109.283 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.453 ' O ' ' OG1' ' A' ' 48' ' ' THR . 5.7 m -50.04 -50.91 46.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.348 -0.845 . . . . 0.0 109.37 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.57 -28.06 58.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.241 -0.912 . . . . 0.0 109.398 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' MET . . . . . 0.546 ' O ' HD21 ' A' ' 51' ' ' LEU . 8.0 ttt -72.22 -22.53 61.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.284 -0.885 . . . . 0.0 109.339 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.574 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -77.09 -53.31 7.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.209 -0.932 . . . . 0.0 109.536 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 53' ' ' THR . 32.3 mttt -52.06 -38.59 57.61 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.166 -0.959 . . . . 0.0 108.48 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.776 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.45 -43.86 75.81 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.606 -0.684 . . . . 0.0 109.282 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.546 HD21 ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER -73.43 -32.25 64.29 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.068 -1.02 . . . . 0.0 109.01 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.52 -31.08 53.22 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.52 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.8 OUTLIER -84.35 -15.04 47.88 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.497 -0.752 . . . . 0.0 109.128 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.52 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 109.469 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.85 161.38 18.34 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.342 -0.849 . . . . 0.0 109.49 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.79 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 35.5 t -72.62 179.74 3.42 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.221 -0.924 . . . . 0.0 109.346 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.718 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -82.91 -43.09 16.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.159 -0.963 . . . . 0.0 109.751 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.0 OUTLIER -137.08 91.86 2.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.0 110.051 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.2 p 153.14 137.52 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.437 -0.789 . . . . 0.0 109.527 179.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.88 71.92 2.67 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.756 2.304 . . . . 0.0 112.209 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.586 ' OE1' ' NE2' ' A' ' 50' ' ' HIS . 2.0 pt20 -153.43 163.26 40.25 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.25 -0.906 . . . . 0.0 109.349 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -140.8 146.81 38.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.247 -0.908 . . . . 0.0 109.683 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.64 159.18 32.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.32 -0.862 . . . . 0.0 109.471 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.488 HH11 ' HD2' ' A' ' 42' ' ' ARG . 24.4 mtm105 -90.17 -72.77 0.55 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.25 153.63 19.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.537 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.596 ' CD2' HG23 ' A' ' 48' ' ' THR . 7.0 t80 -58.72 -35.56 72.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.0 109.32 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -44.8 45.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 109.141 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.48 -33.12 48.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.357 -0.839 . . . . 0.0 109.097 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.12 63.51 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.313 -0.867 . . . . 0.0 109.255 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.596 HG23 ' CD2' ' A' ' 44' ' ' PHE . 3.4 p -70.59 -52.18 23.26 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.877 . . . . 0.0 109.309 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -51.99 -39.06 58.81 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.79 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -51.9 -44.5 63.82 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.415 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 1.9 mt -61.28 -45.53 94.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.141 -0.974 . . . . 0.0 108.931 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -71.08 -19.51 62.46 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.582 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.4 OUTLIER -100.01 -5.0 28.81 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.582 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 109.636 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.587 ' O ' ' O ' ' A' ' 31' ' ' PRO . 0.0 OUTLIER -93.52 169.53 10.03 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.295 -0.878 . . . . 0.0 109.441 -179.879 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.587 ' O ' ' O ' ' A' ' 30' ' ' LYS . 53.2 Cg_exo -46.81 -161.73 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.753 2.302 . . . . 0.0 112.181 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -100.05 102.2 13.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.177 -0.952 . . . . 0.0 109.502 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.81 167.96 10.78 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.274 -0.891 . . . . 0.0 109.457 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.58 ' SG ' ' N ' ' A' ' 35' ' ' SER . 45.3 t -82.92 -176.85 6.53 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.58 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 68.2 m -90.73 -64.3 1.15 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.239 -0.913 . . . . 0.0 109.516 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.692 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.5 tt -110.66 91.37 3.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.155 -0.965 . . . . 0.0 109.477 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.692 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.6 p 150.71 129.9 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.511 -0.743 . . . . 0.0 109.163 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.43 69.65 4.16 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.591 2.194 . . . . 0.0 112.165 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.44 ' OE1' ' NE2' ' A' ' 50' ' ' HIS . 7.3 pt20 -144.81 165.1 29.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.216 -0.927 . . . . 0.0 109.59 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 mtt180 -142.56 153.65 43.74 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.25 -0.906 . . . . 0.0 109.408 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 p -125.44 158.11 35.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -96.52 -22.88 16.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.223 -0.923 . . . . 0.0 109.567 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.54 140.33 27.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.51 ' O ' HG23 ' A' ' 48' ' ' THR . 3.0 t80 -47.7 -32.95 6.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.58 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.0 OUTLIER -50.07 -53.6 26.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.462 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.18 -38.06 63.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.333 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.2 ttt -58.79 -30.76 67.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.247 -0.908 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.58 ' OG1' ' O ' ' A' ' 45' ' ' SER . 18.0 p -67.26 -53.26 31.55 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.443 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 53' ' ' THR . 8.8 mtpp -52.07 -40.9 61.87 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.137 -0.977 . . . . 0.0 108.365 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.743 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.13 -42.35 63.26 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.689 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.484 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -71.0 -44.31 66.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.998 -1.064 . . . . 0.0 108.97 179.817 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 mtm-85 -68.79 -15.91 63.64 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.911 . . . . 0.0 108.72 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.52 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -104.06 -6.49 21.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.462 -0.774 . . . . 0.0 109.297 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.52 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -34.88 -75.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.366 -0.834 . . . . 0.0 109.416 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.271 0 CA-C-O 117.978 -1.457 . . . . 0.0 109.535 179.996 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.304 0.573 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.7 tttp -116.23 91.02 31.12 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.224 -0.923 . . . . 0.0 109.372 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -78.12 -161.32 0.14 Allowed 'Trans proline' 0 C--N 1.306 -1.681 0 C-N-CA 122.773 2.315 . . . . 0.0 112.298 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.32 71.14 0.94 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.179 -0.951 . . . . 0.0 109.506 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.45 154.7 23.26 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 109.447 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.61 ' SG ' ' N ' ' A' ' 35' ' ' SER . 49.5 t -78.83 -177.81 5.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.238 -0.914 . . . . 0.0 109.626 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.61 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 1.8 t -84.85 -82.68 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.262 -0.899 . . . . 0.0 109.529 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.675 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 3.8 tt -93.22 90.81 6.98 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.285 -0.884 . . . . 0.0 109.291 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.675 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.1 p 153.68 86.3 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -45.05 78.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.818 2.346 . . . . 0.0 112.342 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.695 HE21 ' C ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -145.32 138.85 26.64 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.194 -0.941 . . . . 0.0 109.442 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.676 ' N ' ' CD ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.81 135.06 53.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.278 -0.889 . . . . 0.0 109.462 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -140.48 147.59 39.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 109.506 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.19 -6.04 17.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.305 -0.872 . . . . 0.0 109.494 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.13 135.06 51.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 109.518 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.512 ' O ' ' N ' ' A' ' 48' ' ' THR . 4.9 t80 -50.16 -39.04 42.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.449 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.505 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.5 t -49.64 -59.94 3.33 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 109.254 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -26.67 68.62 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.197 -0.94 . . . . 0.0 109.194 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.4 ttp -80.18 -27.47 38.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.306 -0.871 . . . . 0.0 109.354 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.512 ' N ' ' O ' ' A' ' 44' ' ' PHE . 0.8 OUTLIER -70.43 -54.92 10.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.237 -0.914 . . . . 0.0 109.432 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 21.5 mttt -52.39 -36.4 53.98 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.687 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.14 -43.61 74.32 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.491 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.608 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.04 -33.5 68.05 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.092 -1.005 . . . . 0.0 108.799 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -79.9 -23.4 41.86 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -92.63 -10.28 37.96 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.077 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -33.0 -82.25 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.441 -0.787 . . . . 0.0 109.595 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 CA-C-O 117.988 -1.451 . . . . 0.0 109.541 -179.973 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.32 0.581 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.86 158.43 37.81 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 0.0 109.36 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -44.83 117.26 1.44 Allowed 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.699 2.266 . . . . 0.0 112.158 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -147.35 133.54 19.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.209 -0.932 . . . . 0.0 109.585 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.32 153.58 20.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.305 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.634 ' SG ' ' N ' ' A' ' 35' ' ' SER . 52.5 t -72.79 179.47 3.63 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.158 -0.964 . . . . 0.0 109.62 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.634 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 3.9 m -80.52 -74.48 0.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.241 -0.912 . . . . 0.0 109.849 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.674 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.8 tp -103.6 91.5 4.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.208 -0.932 . . . . 0.0 109.617 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.674 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 0.9 OUTLIER 154.54 93.58 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.372 -0.83 . . . . 0.0 109.255 179.778 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -48.39 79.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.748 2.299 . . . . 0.0 112.318 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 1.9 pt20 -153.36 142.48 21.37 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.293 -0.879 . . . . 0.0 109.546 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.74 140.47 48.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.451 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.41 172.27 8.46 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.131 -0.981 . . . . 0.0 109.479 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.36 -65.53 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.0 109.527 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -96.11 -179.36 4.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.115 -0.991 . . . . 0.0 109.61 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 48' ' ' THR . 3.5 t80 -79.03 -37.32 39.4 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.227 -0.921 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.48 ' O ' ' OG1' ' A' ' 48' ' ' THR . 38.9 t -49.61 -50.35 43.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.196 -0.94 . . . . 0.0 109.197 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.37 -38.85 74.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.14 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.9 ttt -66.97 -31.84 72.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.346 -0.846 . . . . 0.0 109.278 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -66.3 -51.86 53.1 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.337 -0.852 . . . . 0.0 109.356 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.446 ' O ' ' N ' ' A' ' 53' ' ' THR . 37.6 mmtt -52.43 -41.39 63.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.714 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.2 -42.46 63.54 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.603 -0.686 . . . . 0.0 109.253 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.541 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -73.21 -40.53 64.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.976 -1.078 . . . . 0.0 108.906 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -71.32 -16.82 62.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.292 -0.88 . . . . 0.0 108.664 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.447 HG22 ' O ' ' A' ' 50' ' ' HIS . 0.6 OUTLIER -101.85 -5.83 24.31 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.515 -0.74 . . . . 0.0 109.167 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.526 ' O ' ' C ' ' A' ' 55' ' ' GLY . 0.1 OUTLIER -41.28 120.87 1.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.349 -0.845 . . . . 0.0 109.503 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.526 ' C ' ' O ' ' A' ' 54' ' ' HIS . . . . . . . . 0 N--CA 1.49 2.288 0 CA-C-O 118.016 -1.436 . . . . 0.0 109.527 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -114.3 86.9 12.65 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.279 -0.888 . . . . 0.0 109.46 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -78.5 -173.98 2.08 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.748 2.299 . . . . 0.0 112.217 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.84 124.65 26.51 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.226 -0.921 . . . . 0.0 109.577 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.21 170.42 7.92 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.165 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.619 ' SG ' ' N ' ' A' ' 35' ' ' SER . 50.0 t -75.8 -179.39 4.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.0 109.603 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.619 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER -87.34 -70.57 0.61 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.283 -0.886 . . . . 0.0 109.778 -179.699 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 37.6 tp -110.08 91.77 3.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.17 -0.956 . . . . 0.0 109.925 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.682 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.2 p 152.93 103.45 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.427 -0.795 . . . . 0.0 109.175 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.3 79.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 122.621 2.214 . . . . 0.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.9 OUTLIER -145.14 140.57 28.08 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.277 -0.89 . . . . 0.0 109.483 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -119.83 140.18 51.21 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.325 -0.859 . . . . 0.0 109.25 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 32.9 p -141.36 167.64 21.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.139 -0.975 . . . . 0.0 109.592 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -129.97 -49.21 1.12 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 0.0 109.289 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -98.41 140.8 32.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.874 . . . . 0.0 109.273 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 48' ' ' THR . 4.3 t80 -52.93 -27.95 21.24 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.162 -0.961 . . . . 0.0 109.557 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.4 OUTLIER -57.8 -43.18 85.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.267 -0.895 . . . . 0.0 109.361 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.95 -36.21 31.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 109.389 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 ttm -68.32 -23.64 64.75 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.245 -0.909 . . . . 0.0 109.354 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.524 HG23 ' O ' ' A' ' 44' ' ' PHE . 4.3 p -71.98 -53.62 12.43 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.239 -0.913 . . . . 0.0 109.312 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.1 mmmt -51.79 -36.57 48.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.68 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.53 -46.4 70.14 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.47 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -66.99 -34.71 78.35 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.059 -1.025 . . . . 0.0 108.574 179.744 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -78.58 -22.06 47.68 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -90.24 -13.73 34.82 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.499 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -38.31 119.36 0.8 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.449 -0.782 . . . . 0.0 109.457 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 CA-C-O 118.028 -1.429 . . . . 0.0 109.535 179.987 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.327 0.584 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.0 mttm -116.26 97.61 49.98 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.187 -0.946 . . . . 0.0 109.349 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -77.07 -99.35 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.682 2.254 . . . . 0.0 112.247 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -142.55 109.23 5.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -0.934 . . . . 0.0 109.525 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 81.6 p -107.52 163.95 12.63 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.226 -0.921 . . . . 0.0 109.406 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 35' ' ' SER . 29.5 t -83.52 -178.07 6.92 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.25 -0.906 . . . . 0.0 109.603 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.491 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.2 OUTLIER -88.55 -77.29 0.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.242 -0.911 . . . . 0.0 109.519 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.663 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 26.4 tp -100.18 91.2 4.64 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.212 -0.93 . . . . 0.0 109.263 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.663 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 0.9 OUTLIER 154.96 93.23 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 109.151 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.39 79.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.806 2.338 . . . . 0.0 112.386 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.639 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 7.1 pt20 -156.15 154.52 31.0 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.127 -0.983 . . . . 0.0 109.628 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 mtm-85 -132.88 154.31 50.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.318 -0.864 . . . . 0.0 109.485 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -130.44 177.42 7.37 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.18 -0.95 . . . . 0.0 109.461 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -126.19 -46.49 1.65 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.392 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.505 ' O ' ' C ' ' A' ' 44' ' ' PHE . 0.4 OUTLIER -116.12 136.03 53.39 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.335 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.505 ' C ' ' O ' ' A' ' 43' ' ' ASP . 6.5 t80 -38.19 -35.55 0.17 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.179 -0.951 . . . . 0.0 109.438 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.45 ' OG ' ' N ' ' A' ' 46' ' ' ALA . 18.2 p -50.81 -57.26 8.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.229 -0.919 . . . . 0.0 109.415 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.45 ' N ' ' OG ' ' A' ' 45' ' ' SER . . . -68.03 -33.82 75.31 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.316 -0.865 . . . . 0.0 109.42 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -37.91 87.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.447 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.464 HG23 ' CE2' ' A' ' 44' ' ' PHE . 0.1 OUTLIER -63.93 -50.27 69.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.555 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 53' ' ' THR . 17.9 mttt -52.95 -42.83 65.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.082 -1.011 . . . . 0.0 108.428 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.696 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.81 -43.02 65.64 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.63 -0.669 . . . . 0.0 109.31 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -73.26 -38.22 66.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.039 -1.038 . . . . 0.0 108.992 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -74.03 -17.75 60.93 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.264 -0.897 . . . . 0.0 108.643 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.549 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -101.33 -8.97 21.6 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.447 -0.783 . . . . 0.0 109.092 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.549 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -34.36 102.29 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.467 -0.771 . . . . 0.0 109.475 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.495 ' O ' ' O ' ' A' ' 54' ' ' HIS . . . . . . . . 0 N--CA 1.49 2.271 0 CA-C-O 117.992 -1.449 . . . . 0.0 109.513 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.56 149.88 48.5 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.322 -0.861 . . . . 0.0 109.504 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.569 ' O ' ' N ' ' A' ' 33' ' ' SER . 48.4 Cg_endo -72.73 131.6 17.42 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.722 2.281 . . . . 0.0 112.141 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -62.65 69.74 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -0.886 . . . . 0.0 109.572 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.569 ' N ' ' O ' ' A' ' 31' ' ' PRO . 56.1 p -87.88 153.53 21.25 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 0.0 109.339 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.576 ' SG ' ' N ' ' A' ' 35' ' ' SER . 45.9 t -77.79 -177.72 5.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.268 -0.895 . . . . 0.0 109.617 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.576 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 35.6 t -91.26 -63.69 1.23 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.216 -0.927 . . . . 0.0 109.491 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.709 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 0.7 OUTLIER -109.62 91.32 3.6 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.151 -0.968 . . . . 0.0 109.58 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.709 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.5 p 150.81 94.34 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.493 -0.754 . . . . 0.0 109.134 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -47.05 75.92 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.719 2.279 . . . . 0.0 112.126 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.692 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 5.8 pt20 -148.89 146.14 27.77 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -0.877 . . . . 0.0 109.505 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -123.0 143.81 49.68 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.495 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.5 p -130.4 -169.98 2.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.293 -0.88 . . . . 0.0 109.504 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.02 -49.94 0.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.619 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.34 137.49 40.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.466 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.678 ' CD2' ' CG2' ' A' ' 48' ' ' THR . 2.3 t80 -45.17 -40.03 6.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.897 . . . . 0.0 109.432 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.0 -42.34 48.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.288 -0.883 . . . . 0.0 109.499 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.2 -32.92 22.4 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.241 -0.912 . . . . 0.0 109.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.3 ttp -74.77 -23.56 58.55 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.343 -0.848 . . . . 0.0 109.37 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.678 ' CG2' ' CD2' ' A' ' 44' ' ' PHE . 26.0 p -76.44 -50.48 13.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 53' ' ' THR . 18.3 mttt -51.55 -38.52 54.68 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.719 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.81 -47.03 71.27 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.52 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.491 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.1 OUTLIER -72.87 -34.83 66.97 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.071 -1.018 . . . . 0.0 108.643 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.46 -15.21 60.44 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.668 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.7 OUTLIER -109.38 -0.51 18.98 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.57 -0.706 . . . . 0.0 109.214 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.458 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -41.37 -15.52 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.272 -0.893 . . . . 0.0 109.458 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.668 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.491 2.308 0 CA-C-O 117.994 -1.448 . . . . 0.0 109.537 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 121.335 0.588 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.409 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.5 OUTLIER -68.29 149.51 98.05 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.3 -0.875 . . . . 0.0 109.531 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -72.62 141.6 34.7 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.843 2.362 . . . . 0.0 112.171 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 101.52 11.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.304 -0.873 . . . . 0.0 109.557 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.87 152.14 18.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.368 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.53 ' SG ' ' N ' ' A' ' 35' ' ' SER . 37.7 t -77.75 -176.25 4.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 109.543 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.53 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 48.4 t -91.78 -72.4 0.59 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.391 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 8.3 tt -102.79 91.76 4.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.682 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.4 p 151.66 92.1 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.615 -0.678 . . . . 0.0 109.206 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -46.53 79.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.721 2.281 . . . . 0.0 112.283 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 37' ' ' CYS . 10.6 pt20 -151.29 141.66 22.43 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.435 ' HB2' ' CZ ' ' A' ' 40' ' ' ARG . 7.9 mtp-105 -125.18 131.95 53.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.196 -0.94 . . . . 0.0 109.586 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.85 150.02 29.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.337 -0.852 . . . . 0.0 109.24 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -89.38 -19.31 25.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.184 -0.947 . . . . 0.0 109.543 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.3 144.5 34.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.246 -0.909 . . . . 0.0 109.435 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -58.03 -35.31 71.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.308 -0.87 . . . . 0.0 109.568 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.6 p -49.42 -39.5 33.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.222 -0.924 . . . . 0.0 109.178 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.66 -27.75 25.17 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.291 -0.881 . . . . 0.0 109.07 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.5 ttt -70.09 -28.05 65.1 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.339 -0.85 . . . . 0.0 109.142 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.6 p -67.31 -51.47 52.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.204 -0.935 . . . . 0.0 109.155 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 53' ' ' THR . 11.1 mttt -53.33 -38.97 63.71 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.72 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.92 -42.05 68.36 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.602 -0.686 . . . . 0.0 109.168 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.575 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -72.88 -39.97 65.98 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.048 -1.033 . . . . 0.0 108.844 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.407 ' HG2' ' NH1' ' A' ' 52' ' ' ARG . 5.2 tpp85 -73.08 -16.7 61.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.539 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -103.83 -5.49 22.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.448 -0.783 . . . . 0.0 109.091 179.671 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.539 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -34.15 149.0 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.483 -0.761 . . . . 0.0 109.631 -179.775 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 118.032 -1.427 . . . . 0.0 109.543 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.409 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 66.3 tt0 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.637 ' C ' ' H ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -72.74 113.96 26.04 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 109.418 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.409 ' HD3' ' O ' ' A' ' 29' ' ' GLU . 50.0 Cg_exo -49.39 5.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.577 2.184 . . . . 0.0 112.282 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.637 ' H ' ' C ' ' A' ' 30' ' ' LYS . 4.3 m-85 -110.34 69.25 0.69 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.241 -0.912 . . . . 0.0 109.665 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.9 158.71 16.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.227 -0.921 . . . . 0.0 109.3 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.617 ' SG ' ' N ' ' A' ' 35' ' ' SER . 51.3 t -73.02 -179.15 3.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.163 -0.961 . . . . 0.0 109.625 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.617 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.6 OUTLIER -89.65 -48.42 7.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.324 -0.86 . . . . 0.0 109.57 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.5 tp -127.47 91.47 3.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.221 -0.924 . . . . 0.0 109.614 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.69 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.6 p 150.01 134.64 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.592 -0.693 . . . . 0.0 109.146 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.4 76.61 3.1 Favored 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.703 2.269 . . . . 0.0 112.313 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 14.0 pt20 -151.54 142.75 23.27 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.187 -0.946 . . . . 0.0 109.424 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.564 ' HD3' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -122.24 150.45 42.28 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.351 -0.843 . . . . 0.0 109.485 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 p -125.9 -172.23 2.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 109.497 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -117.48 -59.53 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -112.98 163.41 14.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.273 -0.892 . . . . 0.0 109.413 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.511 ' O ' HG23 ' A' ' 48' ' ' THR . 18.3 t80 -62.16 -32.98 73.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.308 -0.87 . . . . 0.0 109.348 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.55 ' O ' ' OG1' ' A' ' 48' ' ' THR . 2.3 p -53.5 -45.2 69.59 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.293 -0.879 . . . . 0.0 109.419 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.78 -42.3 28.25 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -0.896 . . . . 0.0 109.4 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.8 ttt -58.81 -27.38 65.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.412 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 45' ' ' SER . 7.9 p -68.25 -50.76 51.73 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.211 -0.93 . . . . 0.0 109.463 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 53' ' ' THR . 2.0 mtpt -52.68 -38.55 60.75 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.699 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.9 -43.7 77.52 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.674 -0.641 . . . . 0.0 109.287 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.58 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -70.82 -36.94 73.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.987 -1.071 . . . . 0.0 108.892 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -76.1 -23.28 54.95 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.562 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -94.76 -8.3 37.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.471 -0.768 . . . . 0.0 109.139 179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.562 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -33.27 -53.56 0.39 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.342 -0.849 . . . . 0.0 109.512 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 CA-C-O 117.986 -1.452 . . . . 0.0 109.597 -179.985 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.449 ' N ' ' CD ' ' A' ' 29' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.07 149.46 73.8 Favored Pre-proline 0 N--CA 1.49 1.531 0 O-C-N 121.259 -0.901 . . . . 0.0 109.38 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -67.59 149.05 79.39 Favored 'Trans proline' 0 C--N 1.306 -1.706 0 C-N-CA 122.762 2.308 . . . . 0.0 111.985 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -124.21 134.44 53.27 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.629 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -92.65 165.68 12.86 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.313 -0.867 . . . . 0.0 109.212 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.746 ' SG ' ' N ' ' A' ' 35' ' ' SER . 35.6 t -74.51 -179.78 4.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.143 -0.973 . . . . 0.0 109.592 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.746 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -84.55 -44.38 13.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.341 -0.849 . . . . 0.0 109.712 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.685 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 6.1 tt -136.94 92.05 2.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.111 -0.993 . . . . 0.0 109.992 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.685 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.3 p 152.36 139.1 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.441 -0.787 . . . . 0.0 109.273 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.18 75.79 2.76 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.721 2.281 . . . . 0.0 112.255 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.695 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 7.3 pt20 -150.79 140.66 21.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.139 -0.975 . . . . 0.0 109.516 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.519 ' HD2' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -128.71 153.63 47.14 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.211 -0.93 . . . . 0.0 109.473 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.41 162.83 33.44 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.205 -0.935 . . . . 0.0 109.49 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtp85 -103.07 -35.13 8.63 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.171 -0.956 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.38 140.77 52.64 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.257 -0.902 . . . . 0.0 109.443 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -47.71 -33.97 7.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.261 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.552 ' O ' ' OG1' ' A' ' 48' ' ' THR . 53.6 p -49.53 -55.53 13.05 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.897 . . . . 0.0 109.212 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.68 -28.55 63.8 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.301 -0.874 . . . . 0.0 109.185 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.452 ' O ' ' CD1' ' A' ' 51' ' ' LEU . 10.3 ttt -72.11 -25.48 61.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.277 -0.89 . . . . 0.0 109.255 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.552 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -72.0 -48.85 41.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.184 -0.947 . . . . 0.0 109.371 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 53' ' ' THR . 7.4 mmtp -51.89 -37.85 53.95 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.71 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.32 -48.47 65.4 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.668 HD12 ' N ' ' A' ' 51' ' ' LEU . 7.3 mp -64.24 -38.96 92.93 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.009 -1.057 . . . . 0.0 108.618 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -73.84 -20.32 60.48 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.53 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -97.98 -9.43 26.14 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.466 -0.771 . . . . 0.0 109.114 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.53 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -34.96 -53.35 0.57 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 109.364 180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.973 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.6 pttm -130.28 150.55 76.47 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.234 -0.917 . . . . 0.0 109.456 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -42.75 117.93 1.03 Allowed 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.79 2.327 . . . . 0.0 112.287 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -69.5 126.1 28.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.295 -0.878 . . . . 0.0 109.431 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.93 156.49 23.9 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.25 -0.906 . . . . 0.0 109.536 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.71 ' SG ' ' N ' ' A' ' 35' ' ' SER . 35.1 t -73.83 178.81 4.61 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 109.512 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.71 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -70.26 -81.69 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.274 -0.891 . . . . 0.0 109.704 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.661 ' C ' ' SG ' ' A' ' 37' ' ' CYS . 33.7 tp -102.1 91.67 4.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.273 -0.892 . . . . 0.0 109.566 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.661 ' SG ' ' C ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER 156.82 94.16 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.413 -0.804 . . . . 0.0 109.283 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -47.93 79.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.726 2.284 . . . . 0.0 112.317 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.566 ' O ' ' OE1' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -146.84 134.56 21.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.482 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.74 133.62 53.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.564 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.71 162.63 19.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.96 . . . . 0.0 109.441 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 43' ' ' ASP . 19.1 ttt-85 -118.59 -6.8 10.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.545 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.502 ' OD1' ' O ' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -146.4 163.28 36.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.198 -0.939 . . . . 0.0 109.487 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.455 ' CE2' HG23 ' A' ' 48' ' ' THR . 23.2 t80 -71.24 -39.99 71.31 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.577 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.7 OUTLIER -49.68 -55.58 13.28 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.293 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.95 -29.55 70.48 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.224 -0.923 . . . . 0.0 109.127 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.3 ttt -73.89 -32.5 63.62 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.392 -0.817 . . . . 0.0 109.334 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.577 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.8 OUTLIER -64.28 -53.05 55.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -0.9 . . . . 0.0 109.358 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 53' ' ' THR . 38.9 mttm -54.23 -37.81 65.02 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.19 -0.944 . . . . 0.0 108.486 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.706 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.81 -40.92 73.41 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.636 -0.665 . . . . 0.0 109.297 179.638 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.571 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.54 -37.61 68.25 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.04 -1.037 . . . . 0.0 108.917 179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -76.29 -22.64 54.8 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.568 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -93.59 -10.91 33.08 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.532 -0.73 . . . . 0.0 109.039 179.639 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.568 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -31.51 -83.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.399 -0.813 . . . . 0.0 109.645 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' A' ' 54' ' ' HIS . . . . . . . . 0 N--CA 1.489 2.21 0 CA-C-O 117.923 -1.487 . . . . 0.0 109.55 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.552 ' OE1' ' N ' ' A' ' 29' ' ' GLU . 25.2 mp0 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' O ' ' N ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -89.91 153.41 47.27 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.3 -0.875 . . . . 0.0 109.459 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -42.23 87.82 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.85 2.367 . . . . 0.0 112.148 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.456 ' N ' ' O ' ' A' ' 30' ' ' LYS . 1.6 m-85 -83.61 121.17 26.89 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.248 -0.908 . . . . 0.0 109.608 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.45 159.0 17.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.292 -0.88 . . . . 0.0 109.374 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.588 ' SG ' ' N ' ' A' ' 35' ' ' SER . 42.5 t -77.64 -178.62 5.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.547 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.588 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 91.7 p -85.86 -67.23 0.82 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.681 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 31.0 tp -111.56 92.8 4.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.675 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.681 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.3 p 152.59 97.13 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.483 -0.761 . . . . 0.0 109.315 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -48.02 76.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.657 2.238 . . . . 0.0 112.308 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.7 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 3.5 pt20 -151.54 141.44 22.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.245 -0.909 . . . . 0.0 109.461 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.3 mtt180 -117.18 162.54 17.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.263 -0.898 . . . . 0.0 109.725 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.558 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 6.5 p -145.0 150.72 37.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.292 -0.88 . . . . 0.0 109.494 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -90.18 -46.5 8.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 0.0 109.35 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.16 161.52 17.04 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.279 -0.888 . . . . 0.0 109.345 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' O ' HG23 ' A' ' 48' ' ' THR . 6.2 t80 -67.36 -34.05 76.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.575 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.6 t -49.71 -57.48 7.17 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.919 . . . . 0.0 109.201 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.74 -34.41 77.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.866 . . . . 0.0 109.142 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.558 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 2.7 ttt -69.26 -29.4 67.29 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.32 -0.863 . . . . 0.0 109.433 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.618 HG23 ' O ' ' A' ' 44' ' ' PHE . 38.1 p -69.66 -49.17 56.18 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.209 -0.932 . . . . 0.0 109.408 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' N ' ' A' ' 53' ' ' THR . 9.0 mttm -51.79 -40.08 59.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.7 ' CG ' ' OE1' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -52.32 -49.0 65.12 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.509 HD12 ' N ' ' A' ' 51' ' ' LEU . 9.9 mp -56.42 -46.8 80.05 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.151 -0.968 . . . . 0.0 108.756 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.18 -18.24 62.49 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.664 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -98.75 -5.26 31.7 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.443 -0.785 . . . . 0.0 109.065 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -32.92 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.366 -0.834 . . . . 0.0 109.365 -179.846 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.664 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.47 149.77 47.4 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.867 . . . . 0.0 109.403 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -68.69 130.87 21.52 Favored 'Trans proline' 0 C--N 1.304 -1.775 0 C-N-CA 122.831 2.354 . . . . 0.0 112.055 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -57.45 115.52 2.79 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.312 -0.867 . . . . 0.0 109.626 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -79.31 170.24 16.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.34 -0.85 . . . . 0.0 109.362 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.757 ' SG ' ' N ' ' A' ' 35' ' ' SER . 19.6 t -81.07 179.02 8.05 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.723 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.757 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -78.79 -51.53 9.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.344 -0.847 . . . . 0.0 109.711 -179.872 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.713 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 4.5 tt -136.86 99.04 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.115 -0.991 . . . . 0.0 109.76 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.713 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.7 p 148.34 143.76 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.618 -0.676 . . . . 0.0 109.199 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -74.86 74.3 3.97 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.654 2.236 . . . . 0.0 112.34 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.665 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 6.1 pt20 -152.88 148.99 27.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -136.01 148.1 48.26 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.179 -0.951 . . . . 0.0 109.658 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 p -128.31 164.95 21.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 109.486 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.83 -46.87 4.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.168 -0.958 . . . . 0.0 109.379 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -112.88 159.49 18.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.365 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.734 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 22.7 t80 -59.63 -36.75 76.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.569 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.5 OUTLIER -49.72 -58.85 4.51 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 109.35 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.65 -33.21 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -28.62 63.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.314 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.734 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 1.6 p -71.13 -52.09 21.27 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -0.913 . . . . 0.0 109.451 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 53' ' ' THR . 13.6 mttt -52.04 -40.03 60.47 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.131 -0.981 . . . . 0.0 108.379 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.701 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.41 -43.9 65.06 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.692 -0.63 . . . . 0.0 109.309 179.587 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.506 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.4 OUTLIER -67.93 -40.3 83.35 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.09 -1.007 . . . . 0.0 108.727 179.869 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -72.87 -19.2 61.34 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.447 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -100.67 -4.27 28.65 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -40.18 147.49 0.1 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.373 -0.829 . . . . 0.0 109.489 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 CA-C-O 117.969 -1.462 . . . . 0.0 109.475 179.877 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.301 0.572 . . . . 0.0 109.487 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -102.9 152.05 38.45 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.206 -0.934 . . . . 0.0 109.5 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -40.99 132.94 2.8 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 122.798 2.332 . . . . 0.0 112.219 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.73 110.07 14.48 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.218 -0.926 . . . . 0.0 109.667 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.7 152.43 26.55 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.333 -0.854 . . . . 0.0 109.114 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 35' ' ' SER . 38.2 t -76.11 -179.18 4.82 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.072 -1.018 . . . . 0.0 109.636 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.508 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 18.2 m -82.87 -89.16 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 0.0 109.486 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.673 ' C ' HD23 ' A' ' 36' ' ' LEU . 7.4 tt -91.25 91.12 8.05 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.169 -0.957 . . . . 0.0 109.106 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.663 ' SG ' ' C ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER 158.55 91.81 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.501 -0.749 . . . . 0.0 109.088 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -46.8 79.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.95 2.433 . . . . 0.0 112.475 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -148.93 136.55 20.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.195 -0.94 . . . . 0.0 109.552 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -127.62 126.84 42.77 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.285 -0.884 . . . . 0.0 109.38 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.607 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 1.4 p -116.06 -167.2 1.23 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.949 . . . . 0.0 109.715 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -128.0 -47.17 1.37 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -0.856 . . . . 0.0 109.319 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.74 174.07 6.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.34 -0.85 . . . . 0.0 109.293 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.528 ' CD2' HG23 ' A' ' 48' ' ' THR . 0.4 OUTLIER -75.05 -33.82 61.78 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.0 109.495 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 m -52.22 -43.37 64.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.261 -0.9 . . . . 0.0 109.484 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.98 -35.03 20.67 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.364 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.607 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 1.8 tpt -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.222 -0.924 . . . . 0.0 109.398 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 44' ' ' PHE . 1.4 p -69.05 -46.05 68.85 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.223 -0.923 . . . . 0.0 109.41 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.4 mttt -53.01 -38.66 62.54 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.755 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.42 -45.9 69.56 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.569 -0.707 . . . . 0.0 109.348 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.68 HD12 ' N ' ' A' ' 51' ' ' LEU . 7.1 mp -66.46 -39.59 88.91 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.046 -1.034 . . . . 0.0 108.873 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -74.65 -19.33 60.32 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.374 -0.828 . . . . 0.0 108.844 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.56 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -96.61 -12.04 24.49 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.413 -0.804 . . . . 0.0 109.01 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.56 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -31.18 -41.23 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.501 -0.749 . . . . 0.0 109.511 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.491 2.315 0 CA-C-O 117.97 -1.461 . . . . 0.0 109.512 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -49.52 143.92 9.83 Favored Pre-proline 0 N--CA 1.49 1.539 0 O-C-N 121.276 -0.89 . . . . 0.0 109.42 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.81 151.96 52.0 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.781 2.32 . . . . 0.0 112.197 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -149.14 165.83 30.61 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.263 -0.898 . . . . 0.0 109.5 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.73 158.4 23.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.258 -0.902 . . . . 0.0 109.431 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.589 ' SG ' ' N ' ' A' ' 35' ' ' SER . 42.7 t -69.79 -176.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.397 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.77 -65.03 1.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.881 . . . . 0.0 109.457 -179.927 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.668 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 60.3 tp -114.79 91.82 3.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.248 -0.908 . . . . 0.0 109.514 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.668 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 0.9 OUTLIER 154.72 101.27 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.364 -0.835 . . . . 0.0 109.323 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -47.99 72.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.633 0 C-N-CA 122.676 2.251 . . . . 0.0 112.212 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -140.17 147.74 40.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.421 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -121.52 145.19 48.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.22 -0.925 . . . . 0.0 109.599 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.51 140.15 42.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.315 -0.866 . . . . 0.0 109.39 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.495 ' CG ' ' N ' ' A' ' 43' ' ' ASP . 5.9 ptp180 -95.97 -42.45 8.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.254 -0.904 . . . . 0.0 109.561 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.495 ' N ' ' CG ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -115.07 161.8 17.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.926 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 32.1 t80 -65.42 -33.37 75.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.886 . . . . 0.0 109.283 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.453 ' O ' ' OG1' ' A' ' 48' ' ' THR . 5.7 m -50.04 -50.91 46.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.348 -0.845 . . . . 0.0 109.37 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.57 -28.06 58.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.241 -0.912 . . . . 0.0 109.398 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.546 ' O ' HD21 ' A' ' 51' ' ' LEU . 8.0 ttt -72.22 -22.53 61.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.284 -0.885 . . . . 0.0 109.339 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.574 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -77.09 -53.31 7.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.209 -0.932 . . . . 0.0 109.536 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 53' ' ' THR . 32.3 mttt -52.06 -38.59 57.61 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.166 -0.959 . . . . 0.0 108.48 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.699 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.45 -43.86 75.81 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.606 -0.684 . . . . 0.0 109.282 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.546 HD21 ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER -73.43 -32.25 64.29 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.068 -1.02 . . . . 0.0 109.01 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.52 -31.08 53.22 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.669 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.8 OUTLIER -84.35 -15.04 47.88 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.497 -0.752 . . . . 0.0 109.128 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.504 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -35.3 89.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 109.469 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.669 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.489 2.219 0 CA-C-O 118.027 -1.43 . . . . 0.0 109.594 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.414 ' O ' ' C ' ' A' ' 30' ' ' LYS . 4.7 mt-10 . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.486 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 6.5 pttp -44.38 152.86 0.48 Allowed Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.293 -0.88 . . . . 0.0 109.36 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -43.36 155.17 0.16 Allowed 'Trans proline' 0 C--N 1.307 -1.633 0 C-N-CA 122.734 2.289 . . . . 0.0 112.044 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.486 ' CD1' ' O ' ' A' ' 30' ' ' LYS . 27.1 m-85 -131.07 82.96 2.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.266 -0.896 . . . . 0.0 109.441 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.85 161.38 18.34 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.342 -0.849 . . . . 0.0 109.49 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.718 ' SG ' ' N ' ' A' ' 35' ' ' SER . 35.5 t -72.62 179.74 3.42 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.221 -0.924 . . . . 0.0 109.346 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.718 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -82.91 -43.09 16.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.159 -0.963 . . . . 0.0 109.751 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.0 OUTLIER -137.08 91.86 2.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.0 110.051 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.69 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.2 p 153.14 137.52 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.437 -0.789 . . . . 0.0 109.527 179.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.88 71.92 2.67 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.756 2.304 . . . . 0.0 112.209 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.586 ' OE1' ' NE2' ' A' ' 50' ' ' HIS . 2.0 pt20 -153.43 163.26 40.25 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.25 -0.906 . . . . 0.0 109.349 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -140.8 146.81 38.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.247 -0.908 . . . . 0.0 109.683 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.64 159.18 32.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.32 -0.862 . . . . 0.0 109.471 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.488 HH11 ' HD2' ' A' ' 42' ' ' ARG . 24.4 mtm105 -90.17 -72.77 0.55 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.25 153.63 19.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.537 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.596 ' CD2' HG23 ' A' ' 48' ' ' THR . 7.0 t80 -58.72 -35.56 72.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.0 109.32 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -44.8 45.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 109.141 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.48 -33.12 48.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.357 -0.839 . . . . 0.0 109.097 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.12 63.51 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.313 -0.867 . . . . 0.0 109.255 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.596 HG23 ' CD2' ' A' ' 44' ' ' PHE . 3.4 p -70.59 -52.18 23.26 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.877 . . . . 0.0 109.309 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -51.99 -39.06 58.81 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.749 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -51.9 -44.5 63.82 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.415 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 1.9 mt -61.28 -45.53 94.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.141 -0.974 . . . . 0.0 108.931 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -71.08 -19.51 62.46 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.582 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.4 OUTLIER -100.01 -5.0 28.81 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.582 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -31.1 -51.73 0.18 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 109.636 -179.826 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 CA-C-O 118.041 -1.422 . . . . 0.0 109.567 179.962 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.81 167.96 10.78 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.274 -0.891 . . . . 0.0 109.457 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.796 ' HG ' ' HE2' ' A' ' 50' ' ' HIS . 45.3 t -82.92 -176.85 6.53 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.58 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 68.2 m -90.73 -64.3 1.15 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.239 -0.913 . . . . 0.0 109.516 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.692 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.5 tt -110.66 91.37 3.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.155 -0.965 . . . . 0.0 109.477 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.74 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.6 p 150.71 129.9 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.511 -0.743 . . . . 0.0 109.163 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.43 69.65 4.16 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.591 2.194 . . . . 0.0 112.165 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.634 HE22 ' CE1' ' A' ' 50' ' ' HIS . 3.9 pt20 -144.81 165.1 29.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.216 -0.927 . . . . 0.0 109.59 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 mtt180 -142.56 153.65 43.74 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.25 -0.906 . . . . 0.0 109.408 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 p -125.44 158.11 35.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -96.52 -22.88 16.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.223 -0.923 . . . . 0.0 109.567 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.54 140.33 27.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.51 ' O ' HG23 ' A' ' 48' ' ' THR . 3.0 t80 -47.7 -32.95 6.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.58 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.0 OUTLIER -50.07 -53.6 26.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.462 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.18 -38.06 63.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.333 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.2 ttt -58.79 -30.76 67.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.247 -0.908 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.58 ' OG1' ' O ' ' A' ' 45' ' ' SER . 18.0 p -67.26 -53.26 31.55 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.443 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 53' ' ' THR . 8.8 mtpp -52.07 -40.9 61.87 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.137 -0.977 . . . . 0.0 108.365 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.796 ' HE2' ' HG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.13 -42.35 63.26 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.689 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.484 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -71.0 -44.31 66.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.998 -1.064 . . . . 0.0 108.97 179.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 mtm-85 -68.79 -15.91 63.64 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.911 . . . . 0.0 108.72 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.52 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -104.06 -6.49 21.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.462 -0.774 . . . . 0.0 109.297 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.52 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.366 -0.834 . . . . 0.0 109.416 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 121.312 0.577 . . . . 0.0 109.506 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.45 154.7 23.26 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 109.447 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.761 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 49.5 t -78.83 -177.81 5.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.238 -0.914 . . . . 0.0 109.626 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.61 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 1.8 t -84.85 -82.68 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.262 -0.899 . . . . 0.0 109.529 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.675 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 3.8 tt -93.22 90.81 6.98 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.285 -0.884 . . . . 0.0 109.291 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.759 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.1 p 153.68 86.3 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -45.05 78.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.818 2.346 . . . . 0.0 112.342 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.695 HE21 ' C ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -145.32 138.85 26.64 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.194 -0.941 . . . . 0.0 109.442 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.676 ' N ' ' CD ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.81 135.06 53.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.278 -0.889 . . . . 0.0 109.462 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -140.48 147.59 39.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 109.506 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.19 -6.04 17.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.305 -0.872 . . . . 0.0 109.494 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.13 135.06 51.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 109.518 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.512 ' O ' ' N ' ' A' ' 48' ' ' THR . 4.9 t80 -50.16 -39.04 42.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.449 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.505 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.5 t -49.64 -59.94 3.33 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 109.254 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -26.67 68.62 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.197 -0.94 . . . . 0.0 109.194 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.4 ttp -80.18 -27.47 38.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.306 -0.871 . . . . 0.0 109.354 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.512 ' N ' ' O ' ' A' ' 44' ' ' PHE . 0.8 OUTLIER -70.43 -54.92 10.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.237 -0.914 . . . . 0.0 109.432 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 21.5 mttt -52.39 -36.4 53.98 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.761 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.14 -43.61 74.32 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.608 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.04 -33.5 68.05 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.092 -1.005 . . . . 0.0 108.799 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -79.9 -23.4 41.86 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -92.63 -10.28 37.96 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.077 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 O-C-N 121.441 -0.787 . . . . 0.0 109.595 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.525 0 CA-C-O 121.254 0.55 . . . . 0.0 109.585 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.32 153.58 20.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.305 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.776 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 52.5 t -72.79 179.47 3.63 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.158 -0.964 . . . . 0.0 109.62 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.634 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 3.9 m -80.52 -74.48 0.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.241 -0.912 . . . . 0.0 109.849 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.674 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.8 tp -103.6 91.5 4.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.208 -0.932 . . . . 0.0 109.617 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.758 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.9 OUTLIER 154.54 93.58 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.372 -0.83 . . . . 0.0 109.255 179.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -48.39 79.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.748 2.299 . . . . 0.0 112.318 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 1.9 pt20 -153.36 142.48 21.37 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.293 -0.879 . . . . 0.0 109.546 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.74 140.47 48.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.451 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.41 172.27 8.46 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.131 -0.981 . . . . 0.0 109.479 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.36 -65.53 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.0 109.527 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -96.11 -179.36 4.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.115 -0.991 . . . . 0.0 109.61 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 48' ' ' THR . 3.5 t80 -79.03 -37.32 39.4 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.227 -0.921 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.48 ' O ' ' OG1' ' A' ' 48' ' ' THR . 38.9 t -49.61 -50.35 43.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.196 -0.94 . . . . 0.0 109.197 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.37 -38.85 74.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.14 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.9 ttt -66.97 -31.84 72.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.346 -0.846 . . . . 0.0 109.278 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -66.3 -51.86 53.1 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.337 -0.852 . . . . 0.0 109.356 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.446 ' O ' ' N ' ' A' ' 53' ' ' THR . 37.6 mmtt -52.43 -41.39 63.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.776 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.2 -42.46 63.54 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.603 -0.686 . . . . 0.0 109.253 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.541 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -73.21 -40.53 64.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.976 -1.078 . . . . 0.0 108.906 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -71.32 -16.82 62.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.292 -0.88 . . . . 0.0 108.664 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.447 HG22 ' O ' ' A' ' 50' ' ' HIS . 0.6 OUTLIER -101.85 -5.83 24.31 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.515 -0.74 . . . . 0.0 109.167 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.442 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.349 -0.845 . . . . 0.0 109.503 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.23 0.538 . . . . 0.0 109.577 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.21 170.42 7.92 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.165 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.825 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 50.0 t -75.8 -179.39 4.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.0 109.603 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.619 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER -87.34 -70.57 0.61 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.283 -0.886 . . . . 0.0 109.778 -179.699 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 37.6 tp -110.08 91.77 3.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.17 -0.956 . . . . 0.0 109.925 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.801 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.2 p 152.93 103.45 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.427 -0.795 . . . . 0.0 109.175 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.3 79.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 122.621 2.214 . . . . 0.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.9 OUTLIER -145.14 140.57 28.08 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.277 -0.89 . . . . 0.0 109.483 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -119.83 140.18 51.21 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.325 -0.859 . . . . 0.0 109.25 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 32.9 p -141.36 167.64 21.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.139 -0.975 . . . . 0.0 109.592 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -129.97 -49.21 1.12 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 0.0 109.289 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -98.41 140.8 32.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.874 . . . . 0.0 109.273 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 48' ' ' THR . 4.3 t80 -52.93 -27.95 21.24 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.162 -0.961 . . . . 0.0 109.557 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.4 OUTLIER -57.8 -43.18 85.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.267 -0.895 . . . . 0.0 109.361 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.95 -36.21 31.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 109.389 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 ttm -68.32 -23.64 64.75 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.245 -0.909 . . . . 0.0 109.354 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.524 HG23 ' O ' ' A' ' 44' ' ' PHE . 4.3 p -71.98 -53.62 12.43 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.239 -0.913 . . . . 0.0 109.312 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.1 mmmt -51.79 -36.57 48.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.825 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -53.53 -46.4 70.14 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.47 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.49 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -66.99 -34.71 78.35 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.059 -1.025 . . . . 0.0 108.574 179.744 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -78.58 -22.06 47.68 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -90.24 -13.73 34.82 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.499 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.449 -0.782 . . . . 0.0 109.457 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 81.6 p -107.52 163.95 12.63 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.226 -0.921 . . . . 0.0 109.406 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.763 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 29.5 t -83.52 -178.07 6.92 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.25 -0.906 . . . . 0.0 109.603 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.491 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.2 OUTLIER -88.55 -77.29 0.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.242 -0.911 . . . . 0.0 109.519 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.663 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 26.4 tp -100.18 91.2 4.64 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.212 -0.93 . . . . 0.0 109.263 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.756 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.9 OUTLIER 154.96 93.23 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 109.151 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.39 79.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.806 2.338 . . . . 0.0 112.386 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.789 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 4.1 pt20 -156.15 154.52 31.0 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.127 -0.983 . . . . 0.0 109.628 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 mtm-85 -132.88 154.31 50.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.318 -0.864 . . . . 0.0 109.485 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -130.44 177.42 7.37 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.18 -0.95 . . . . 0.0 109.461 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -126.19 -46.49 1.65 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.392 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.505 ' O ' ' C ' ' A' ' 44' ' ' PHE . 0.4 OUTLIER -116.12 136.03 53.39 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.335 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.505 ' C ' ' O ' ' A' ' 43' ' ' ASP . 6.5 t80 -38.19 -35.55 0.17 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.179 -0.951 . . . . 0.0 109.438 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.45 ' OG ' ' N ' ' A' ' 46' ' ' ALA . 18.2 p -50.81 -57.26 8.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.229 -0.919 . . . . 0.0 109.415 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.45 ' N ' ' OG ' ' A' ' 45' ' ' SER . . . -68.03 -33.82 75.31 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.316 -0.865 . . . . 0.0 109.42 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -37.91 87.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.447 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.464 HG23 ' CE2' ' A' ' 44' ' ' PHE . 0.1 OUTLIER -63.93 -50.27 69.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.555 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 53' ' ' THR . 17.9 mttt -52.95 -42.83 65.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.082 -1.011 . . . . 0.0 108.428 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.789 ' CE1' ' NE2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -52.81 -43.02 65.64 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.63 -0.669 . . . . 0.0 109.31 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -73.26 -38.22 66.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.039 -1.038 . . . . 0.0 108.992 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -74.03 -17.75 60.93 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.264 -0.897 . . . . 0.0 108.643 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.549 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -101.33 -8.97 21.6 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.447 -0.783 . . . . 0.0 109.092 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.549 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.467 -0.771 . . . . 0.0 109.475 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 56.1 p -87.88 153.53 21.25 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 0.0 109.339 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.76 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 45.9 t -77.79 -177.72 5.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.268 -0.895 . . . . 0.0 109.617 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.576 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 35.6 t -91.26 -63.69 1.23 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.216 -0.927 . . . . 0.0 109.491 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.709 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 0.7 OUTLIER -109.62 91.32 3.6 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.151 -0.968 . . . . 0.0 109.58 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.758 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.5 p 150.81 94.34 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.493 -0.754 . . . . 0.0 109.134 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -47.05 75.92 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.719 2.279 . . . . 0.0 112.126 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.692 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 5.8 pt20 -148.89 146.14 27.77 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -0.877 . . . . 0.0 109.505 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -123.0 143.81 49.68 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.495 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.5 p -130.4 -169.98 2.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.293 -0.88 . . . . 0.0 109.504 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.02 -49.94 0.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.619 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.34 137.49 40.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.466 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.678 ' CD2' ' CG2' ' A' ' 48' ' ' THR . 2.3 t80 -45.17 -40.03 6.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.897 . . . . 0.0 109.432 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.0 -42.34 48.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.288 -0.883 . . . . 0.0 109.499 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.2 -32.92 22.4 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.241 -0.912 . . . . 0.0 109.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.3 ttp -74.77 -23.56 58.55 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.343 -0.848 . . . . 0.0 109.37 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.678 ' CG2' ' CD2' ' A' ' 44' ' ' PHE . 26.0 p -76.44 -50.48 13.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 53' ' ' THR . 18.3 mttt -51.55 -38.52 54.68 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.76 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -53.81 -47.03 71.27 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.52 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.491 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -72.87 -34.83 66.97 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.071 -1.018 . . . . 0.0 108.643 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.46 -15.21 60.44 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.524 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -109.38 -0.51 18.98 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.57 -0.706 . . . . 0.0 109.214 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.458 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.272 -0.893 . . . . 0.0 109.458 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.87 152.14 18.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.368 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.752 ' SG ' ' SG ' ' A' ' 37' ' ' CYS . 37.7 t -77.75 -176.25 4.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 109.543 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.53 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 48.4 t -91.78 -72.4 0.59 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.391 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 8.3 tt -102.79 91.76 4.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.752 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.4 p 151.66 92.1 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.615 -0.678 . . . . 0.0 109.206 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -46.53 79.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.721 2.281 . . . . 0.0 112.283 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 37' ' ' CYS . 10.6 pt20 -151.29 141.66 22.43 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.435 ' CZ ' ' HB2' ' A' ' 40' ' ' ARG . 7.9 mtp-105 -125.18 131.95 53.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.196 -0.94 . . . . 0.0 109.586 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.85 150.02 29.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.337 -0.852 . . . . 0.0 109.24 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -89.38 -19.31 25.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.184 -0.947 . . . . 0.0 109.543 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.3 144.5 34.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.246 -0.909 . . . . 0.0 109.435 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -58.03 -35.31 71.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.308 -0.87 . . . . 0.0 109.568 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.6 p -49.42 -39.5 33.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.222 -0.924 . . . . 0.0 109.178 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.66 -27.75 25.17 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.291 -0.881 . . . . 0.0 109.07 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.5 ttt -70.09 -28.05 65.1 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.339 -0.85 . . . . 0.0 109.142 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.6 p -67.31 -51.47 52.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.204 -0.935 . . . . 0.0 109.155 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 53' ' ' THR . 11.1 mttt -53.33 -38.97 63.71 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.72 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.92 -42.05 68.36 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.602 -0.686 . . . . 0.0 109.168 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.575 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -72.88 -39.97 65.98 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.048 -1.033 . . . . 0.0 108.844 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.407 ' HG2' ' NH1' ' A' ' 52' ' ' ARG . 5.2 tpp85 -73.08 -16.7 61.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.539 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -103.83 -5.49 22.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.448 -0.783 . . . . 0.0 109.091 179.671 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.539 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.483 -0.761 . . . . 0.0 109.631 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.256 0.55 . . . . 0.0 109.665 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.9 158.71 16.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.227 -0.921 . . . . 0.0 109.3 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.788 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 51.3 t -73.02 -179.15 3.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.163 -0.961 . . . . 0.0 109.625 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.617 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.6 OUTLIER -89.65 -48.42 7.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.324 -0.86 . . . . 0.0 109.57 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.5 tp -127.47 91.47 3.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.221 -0.924 . . . . 0.0 109.614 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.775 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.6 p 150.01 134.64 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.592 -0.693 . . . . 0.0 109.146 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.4 76.61 3.1 Favored 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.703 2.269 . . . . 0.0 112.313 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 14.0 pt20 -151.54 142.75 23.27 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.187 -0.946 . . . . 0.0 109.424 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.564 ' HD3' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -122.24 150.45 42.28 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.351 -0.843 . . . . 0.0 109.485 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 p -125.9 -172.23 2.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 109.497 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -117.48 -59.53 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -112.98 163.41 14.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.273 -0.892 . . . . 0.0 109.413 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.511 ' O ' HG23 ' A' ' 48' ' ' THR . 18.3 t80 -62.16 -32.98 73.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.308 -0.87 . . . . 0.0 109.348 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.55 ' O ' ' OG1' ' A' ' 48' ' ' THR . 2.3 p -53.5 -45.2 69.59 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.293 -0.879 . . . . 0.0 109.419 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.78 -42.3 28.25 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -0.896 . . . . 0.0 109.4 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.8 ttt -58.81 -27.38 65.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.412 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 45' ' ' SER . 7.9 p -68.25 -50.76 51.73 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.211 -0.93 . . . . 0.0 109.463 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 53' ' ' THR . 2.0 mtpt -52.68 -38.55 60.75 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.788 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.9 -43.7 77.52 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.674 -0.641 . . . . 0.0 109.287 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.58 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -70.82 -36.94 73.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.987 -1.071 . . . . 0.0 108.892 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -76.1 -23.28 54.95 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.562 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -94.76 -8.3 37.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.471 -0.768 . . . . 0.0 109.139 179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.562 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.342 -0.849 . . . . 0.0 109.512 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.315 0.579 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -92.65 165.68 12.86 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.313 -0.867 . . . . 0.0 109.212 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.832 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 35.6 t -74.51 -179.78 4.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.143 -0.973 . . . . 0.0 109.592 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.746 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -84.55 -44.38 13.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.341 -0.849 . . . . 0.0 109.712 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.685 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 6.1 tt -136.94 92.05 2.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.111 -0.993 . . . . 0.0 109.992 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.805 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.3 p 152.36 139.1 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.441 -0.787 . . . . 0.0 109.273 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.18 75.79 2.76 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.721 2.281 . . . . 0.0 112.255 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.695 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 7.3 pt20 -150.79 140.66 21.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.139 -0.975 . . . . 0.0 109.516 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.519 ' HD2' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -128.71 153.63 47.14 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.211 -0.93 . . . . 0.0 109.473 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.41 162.83 33.44 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.205 -0.935 . . . . 0.0 109.49 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtp85 -103.07 -35.13 8.63 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.171 -0.956 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.38 140.77 52.64 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.257 -0.902 . . . . 0.0 109.443 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -47.71 -33.97 7.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.261 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.552 ' O ' ' OG1' ' A' ' 48' ' ' THR . 53.6 p -49.53 -55.53 13.05 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.897 . . . . 0.0 109.212 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.68 -28.55 63.8 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.301 -0.874 . . . . 0.0 109.185 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.452 ' O ' ' CD1' ' A' ' 51' ' ' LEU . 10.3 ttt -72.11 -25.48 61.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.277 -0.89 . . . . 0.0 109.255 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.552 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -72.0 -48.85 41.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.184 -0.947 . . . . 0.0 109.371 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 53' ' ' THR . 7.4 mmtp -51.89 -37.85 53.95 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.832 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.32 -48.47 65.4 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.668 ' N ' HD12 ' A' ' 51' ' ' LEU . 7.3 mp -64.24 -38.96 92.93 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.009 -1.057 . . . . 0.0 108.618 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -73.84 -20.32 60.48 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.53 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -97.98 -9.43 26.14 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.466 -0.771 . . . . 0.0 109.114 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.53 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 109.364 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.93 156.49 23.9 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.25 -0.906 . . . . 0.0 109.536 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.773 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 35.1 t -73.83 178.81 4.61 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 109.512 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.71 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -70.26 -81.69 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.274 -0.891 . . . . 0.0 109.704 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.661 ' C ' ' SG ' ' A' ' 37' ' ' CYS . 33.7 tp -102.1 91.67 4.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.273 -0.892 . . . . 0.0 109.566 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.744 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER 156.82 94.16 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.413 -0.804 . . . . 0.0 109.283 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -47.93 79.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.726 2.284 . . . . 0.0 112.317 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.566 ' OE1' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -146.84 134.56 21.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.482 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.74 133.62 53.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.564 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.71 162.63 19.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.96 . . . . 0.0 109.441 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 43' ' ' ASP . 19.1 ttt-85 -118.59 -6.8 10.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.545 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.502 ' OD1' ' O ' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -146.4 163.28 36.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.198 -0.939 . . . . 0.0 109.487 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.455 ' CE2' HG23 ' A' ' 48' ' ' THR . 23.2 t80 -71.24 -39.99 71.31 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.577 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.7 OUTLIER -49.68 -55.58 13.28 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.293 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.95 -29.55 70.48 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.224 -0.923 . . . . 0.0 109.127 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.3 ttt -73.89 -32.5 63.62 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.392 -0.817 . . . . 0.0 109.334 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.577 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.8 OUTLIER -64.28 -53.05 55.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -0.9 . . . . 0.0 109.358 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 53' ' ' THR . 38.9 mttm -54.23 -37.81 65.02 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.19 -0.944 . . . . 0.0 108.486 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.773 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.81 -40.92 73.41 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.636 -0.665 . . . . 0.0 109.297 179.638 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.571 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.54 -37.61 68.25 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.04 -1.037 . . . . 0.0 108.917 179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -76.29 -22.64 54.8 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.568 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -93.59 -10.91 33.08 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.532 -0.73 . . . . 0.0 109.039 179.639 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.568 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.399 -0.813 . . . . 0.0 109.645 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.267 0.556 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.45 159.0 17.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.292 -0.88 . . . . 0.0 109.374 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.789 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 42.5 t -77.64 -178.62 5.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.547 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.588 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 91.7 p -85.86 -67.23 0.82 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.681 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 31.0 tp -111.56 92.8 4.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.675 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.756 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.3 p 152.59 97.13 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.483 -0.761 . . . . 0.0 109.315 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -48.02 76.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.657 2.238 . . . . 0.0 112.308 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.7 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 3.5 pt20 -151.54 141.44 22.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.245 -0.909 . . . . 0.0 109.461 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.3 mtt180 -117.18 162.54 17.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.263 -0.898 . . . . 0.0 109.725 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.558 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 6.5 p -145.0 150.72 37.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.292 -0.88 . . . . 0.0 109.494 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -90.18 -46.5 8.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 0.0 109.35 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.16 161.52 17.04 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.279 -0.888 . . . . 0.0 109.345 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' O ' HG23 ' A' ' 48' ' ' THR . 6.2 t80 -67.36 -34.05 76.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.575 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.6 t -49.71 -57.48 7.17 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.919 . . . . 0.0 109.201 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.74 -34.41 77.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.866 . . . . 0.0 109.142 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.558 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 2.7 ttt -69.26 -29.4 67.29 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.32 -0.863 . . . . 0.0 109.433 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.618 HG23 ' O ' ' A' ' 44' ' ' PHE . 38.1 p -69.66 -49.17 56.18 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.209 -0.932 . . . . 0.0 109.408 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' N ' ' A' ' 53' ' ' THR . 9.0 mttm -51.79 -40.08 59.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.789 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.32 -49.0 65.12 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 51' ' ' LEU . 9.9 mp -56.42 -46.8 80.05 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.151 -0.968 . . . . 0.0 108.756 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.18 -18.24 62.49 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.558 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -98.75 -5.26 31.7 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.443 -0.785 . . . . 0.0 109.065 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.366 -0.834 . . . . 0.0 109.365 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.247 0.546 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -79.31 170.24 16.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.34 -0.85 . . . . 0.0 109.362 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.798 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 19.6 t -81.07 179.02 8.05 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.723 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.757 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -78.79 -51.53 9.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.344 -0.847 . . . . 0.0 109.711 -179.872 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.713 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 4.5 tt -136.86 99.04 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.115 -0.991 . . . . 0.0 109.76 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.79 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.7 p 148.34 143.76 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.618 -0.676 . . . . 0.0 109.199 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -74.86 74.3 3.97 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.654 2.236 . . . . 0.0 112.34 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.665 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 6.1 pt20 -152.88 148.99 27.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -136.01 148.1 48.26 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.179 -0.951 . . . . 0.0 109.658 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 p -128.31 164.95 21.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 109.486 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.83 -46.87 4.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.168 -0.958 . . . . 0.0 109.379 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -112.88 159.49 18.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.365 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.734 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 22.7 t80 -59.63 -36.75 76.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.569 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.5 OUTLIER -49.72 -58.85 4.51 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 109.35 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.65 -33.21 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -28.62 63.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.314 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.734 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 1.6 p -71.13 -52.09 21.27 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -0.913 . . . . 0.0 109.451 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 53' ' ' THR . 13.6 mttt -52.04 -40.03 60.47 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.131 -0.981 . . . . 0.0 108.379 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.798 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -52.41 -43.9 65.06 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.692 -0.63 . . . . 0.0 109.309 179.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.506 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -67.93 -40.3 83.35 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.09 -1.007 . . . . 0.0 108.727 179.869 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -72.87 -19.2 61.34 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.447 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -100.67 -4.27 28.65 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.373 -0.829 . . . . 0.0 109.489 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.296 0.57 . . . . 0.0 109.667 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.7 152.43 26.55 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.333 -0.854 . . . . 0.0 109.114 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.767 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 38.2 t -76.11 -179.18 4.82 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.072 -1.018 . . . . 0.0 109.636 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.508 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 18.2 m -82.87 -89.16 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 0.0 109.486 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.673 HD23 ' C ' ' A' ' 36' ' ' LEU . 7.4 tt -91.25 91.12 8.05 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.169 -0.957 . . . . 0.0 109.106 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.751 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER 158.55 91.81 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.501 -0.749 . . . . 0.0 109.088 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -46.8 79.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.95 2.433 . . . . 0.0 112.475 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -148.93 136.55 20.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.195 -0.94 . . . . 0.0 109.552 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -127.62 126.84 42.77 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.285 -0.884 . . . . 0.0 109.38 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.607 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 1.4 p -116.06 -167.2 1.23 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.949 . . . . 0.0 109.715 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -128.0 -47.17 1.37 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -0.856 . . . . 0.0 109.319 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.74 174.07 6.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.34 -0.85 . . . . 0.0 109.293 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.528 ' CD2' HG23 ' A' ' 48' ' ' THR . 0.4 OUTLIER -75.05 -33.82 61.78 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.0 109.495 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 m -52.22 -43.37 64.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.261 -0.9 . . . . 0.0 109.484 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.98 -35.03 20.67 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.364 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.607 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 1.8 tpt -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.222 -0.924 . . . . 0.0 109.398 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 44' ' ' PHE . 1.4 p -69.05 -46.05 68.85 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.223 -0.923 . . . . 0.0 109.41 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.4 mttt -53.01 -38.66 62.54 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.767 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -53.42 -45.9 69.56 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.569 -0.707 . . . . 0.0 109.348 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.68 ' N ' HD12 ' A' ' 51' ' ' LEU . 7.1 mp -66.46 -39.59 88.91 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.046 -1.034 . . . . 0.0 108.873 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -74.65 -19.33 60.32 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.374 -0.828 . . . . 0.0 108.844 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.56 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -96.61 -12.04 24.49 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.413 -0.804 . . . . 0.0 109.01 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.56 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.501 -0.749 . . . . 0.0 109.511 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.73 158.4 23.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.258 -0.902 . . . . 0.0 109.431 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.776 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 42.7 t -69.79 -176.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.397 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.77 -65.03 1.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.881 . . . . 0.0 109.457 -179.927 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.668 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 60.3 tp -114.79 91.82 3.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.248 -0.908 . . . . 0.0 109.514 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.756 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 0.9 OUTLIER 154.72 101.27 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.364 -0.835 . . . . 0.0 109.323 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -47.99 72.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.633 0 C-N-CA 122.676 2.251 . . . . 0.0 112.212 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -140.17 147.74 40.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.421 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -121.52 145.19 48.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.22 -0.925 . . . . 0.0 109.599 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.51 140.15 42.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.315 -0.866 . . . . 0.0 109.39 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.495 ' CG ' ' N ' ' A' ' 43' ' ' ASP . 5.9 ptp180 -95.97 -42.45 8.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.254 -0.904 . . . . 0.0 109.561 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.495 ' N ' ' CG ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -115.07 161.8 17.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.926 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 32.1 t80 -65.42 -33.37 75.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.886 . . . . 0.0 109.283 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.453 ' O ' ' OG1' ' A' ' 48' ' ' THR . 5.7 m -50.04 -50.91 46.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.348 -0.845 . . . . 0.0 109.37 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.57 -28.06 58.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.241 -0.912 . . . . 0.0 109.398 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . 0.546 ' O ' HD21 ' A' ' 51' ' ' LEU . 8.0 ttt -72.22 -22.53 61.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.284 -0.885 . . . . 0.0 109.339 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.574 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -77.09 -53.31 7.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.209 -0.932 . . . . 0.0 109.536 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 53' ' ' THR . 32.3 mttt -52.06 -38.59 57.61 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.166 -0.959 . . . . 0.0 108.48 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.776 ' NE2' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -55.45 -43.86 75.81 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.606 -0.684 . . . . 0.0 109.282 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.546 HD21 ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER -73.43 -32.25 64.29 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.068 -1.02 . . . . 0.0 109.01 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.52 -31.08 53.22 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.52 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.8 OUTLIER -84.35 -15.04 47.88 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.497 -0.752 . . . . 0.0 109.128 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.52 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 109.469 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.85 161.38 18.34 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.342 -0.849 . . . . 0.0 109.49 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.79 ' SG ' ' NE2' ' A' ' 50' ' ' HIS . 35.5 t -72.62 179.74 3.42 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.221 -0.924 . . . . 0.0 109.346 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.718 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -82.91 -43.09 16.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.159 -0.963 . . . . 0.0 109.751 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.0 OUTLIER -137.08 91.86 2.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.0 110.051 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.768 ' SG ' ' SG ' ' A' ' 34' ' ' CYS . 1.2 p 153.14 137.52 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.437 -0.789 . . . . 0.0 109.527 179.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.88 71.92 2.67 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.756 2.304 . . . . 0.0 112.209 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.873 HE21 ' CD2' ' A' ' 50' ' ' HIS . 9.2 pt20 -153.43 163.26 40.25 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.25 -0.906 . . . . 0.0 109.349 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -140.8 146.81 38.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.247 -0.908 . . . . 0.0 109.683 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.64 159.18 32.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.32 -0.862 . . . . 0.0 109.471 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.488 HH11 ' HD2' ' A' ' 42' ' ' ARG . 24.4 mtm105 -90.17 -72.77 0.55 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.25 153.63 19.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.537 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.596 ' CD2' HG23 ' A' ' 48' ' ' THR . 7.0 t80 -58.72 -35.56 72.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.0 109.32 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -44.8 45.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 109.141 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.48 -33.12 48.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.357 -0.839 . . . . 0.0 109.097 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.12 63.51 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.313 -0.867 . . . . 0.0 109.255 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.596 HG23 ' CD2' ' A' ' 44' ' ' PHE . 3.4 p -70.59 -52.18 23.26 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.877 . . . . 0.0 109.309 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -51.99 -39.06 58.81 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.873 ' CD2' HE21 ' A' ' 39' ' ' GLN . 0.0 OUTLIER -51.9 -44.5 63.82 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.415 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 1.9 mt -61.28 -45.53 94.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.141 -0.974 . . . . 0.0 108.931 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -71.08 -19.51 62.46 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.582 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.4 OUTLIER -100.01 -5.0 28.81 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.582 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 109.636 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.587 ' O ' ' O ' ' A' ' 31' ' ' PRO . 0.0 OUTLIER -93.52 169.53 10.03 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.295 -0.878 . . . . 0.0 109.441 -179.879 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.587 ' O ' ' O ' ' A' ' 30' ' ' LYS . 53.2 Cg_exo -46.81 -161.73 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.753 2.302 . . . . 0.0 112.181 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -100.05 102.2 13.48 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.177 -0.952 . . . . 0.0 109.502 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.81 167.96 10.78 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.274 -0.891 . . . . 0.0 109.457 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.58 ' SG ' ' N ' ' A' ' 35' ' ' SER . 45.3 t -82.92 -176.85 6.53 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.58 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 68.2 m -90.73 -64.3 1.15 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.239 -0.913 . . . . 0.0 109.516 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.692 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.5 tt -110.66 91.37 3.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.155 -0.965 . . . . 0.0 109.477 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.692 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.6 p 150.71 129.9 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.511 -0.743 . . . . 0.0 109.163 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.43 69.65 4.16 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.591 2.194 . . . . 0.0 112.165 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.634 HE22 ' CE1' ' A' ' 50' ' ' HIS . 3.9 pt20 -144.81 165.1 29.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.216 -0.927 . . . . 0.0 109.59 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 mtt180 -142.56 153.65 43.74 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.25 -0.906 . . . . 0.0 109.408 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 p -125.44 158.11 35.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 38.8 mtt180 -96.52 -22.88 16.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.223 -0.923 . . . . 0.0 109.567 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -145.54 140.33 27.38 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.195 -0.941 . . . . 0.0 109.451 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.51 ' O ' HG23 ' A' ' 48' ' ' THR . 3.0 t80 -47.7 -32.95 6.31 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.23 -0.919 . . . . 0.0 109.421 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.58 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.0 OUTLIER -50.07 -53.6 26.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.916 . . . . 0.0 109.462 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -74.18 -38.06 63.78 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.223 -0.923 . . . . 0.0 109.333 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.2 ttt -58.79 -30.76 67.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.247 -0.908 . . . . 0.0 109.311 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.58 ' OG1' ' O ' ' A' ' 45' ' ' SER . 18.0 p -67.26 -53.26 31.55 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.295 -0.878 . . . . 0.0 109.443 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 53' ' ' THR . 8.8 mtpp -52.07 -40.9 61.87 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.137 -0.977 . . . . 0.0 108.365 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.743 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.13 -42.35 63.26 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.689 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.484 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -71.0 -44.31 66.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.998 -1.064 . . . . 0.0 108.97 179.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 mtm-85 -68.79 -15.91 63.64 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.243 -0.911 . . . . 0.0 108.72 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.52 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -104.06 -6.49 21.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.462 -0.774 . . . . 0.0 109.297 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.52 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -34.88 -75.47 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.366 -0.834 . . . . 0.0 109.416 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.271 0 CA-C-O 117.978 -1.457 . . . . 0.0 109.535 179.996 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.304 0.573 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.7 tttp -116.23 91.02 31.12 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.224 -0.923 . . . . 0.0 109.372 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -78.12 -161.32 0.14 Allowed 'Trans proline' 0 C--N 1.306 -1.681 0 C-N-CA 122.773 2.315 . . . . 0.0 112.298 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -152.32 71.14 0.94 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.179 -0.951 . . . . 0.0 109.506 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -110.45 154.7 23.26 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.229 -0.919 . . . . 0.0 109.447 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.61 ' SG ' ' N ' ' A' ' 35' ' ' SER . 49.5 t -78.83 -177.81 5.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.238 -0.914 . . . . 0.0 109.626 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.61 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 1.8 t -84.85 -82.68 0.17 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.262 -0.899 . . . . 0.0 109.529 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.675 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 3.8 tt -93.22 90.81 6.98 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.285 -0.884 . . . . 0.0 109.291 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.675 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.1 p 153.68 86.3 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.604 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -45.05 78.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.818 2.346 . . . . 0.0 112.342 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.695 HE21 ' C ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -145.32 138.85 26.64 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.194 -0.941 . . . . 0.0 109.442 179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.676 ' N ' ' CD ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -123.81 135.06 53.56 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.278 -0.889 . . . . 0.0 109.462 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.8 m -140.48 147.59 39.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.269 -0.895 . . . . 0.0 109.506 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.19 -6.04 17.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.305 -0.872 . . . . 0.0 109.494 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.13 135.06 51.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.294 -0.879 . . . . 0.0 109.518 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.512 ' O ' ' N ' ' A' ' 48' ' ' THR . 4.9 t80 -50.16 -39.04 42.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.449 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.505 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.5 t -49.64 -59.94 3.33 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.932 . . . . 0.0 109.254 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -26.67 68.62 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.197 -0.94 . . . . 0.0 109.194 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.4 ttp -80.18 -27.47 38.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.306 -0.871 . . . . 0.0 109.354 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.512 ' N ' ' O ' ' A' ' 44' ' ' PHE . 0.8 OUTLIER -70.43 -54.92 10.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.237 -0.914 . . . . 0.0 109.432 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 21.5 mttt -52.39 -36.4 53.98 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.687 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.14 -43.61 74.32 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.608 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.04 -33.5 68.05 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.092 -1.005 . . . . 0.0 108.799 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -79.9 -23.4 41.86 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -92.63 -10.28 37.96 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.385 -0.822 . . . . 0.0 109.077 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -33.0 -82.25 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.441 -0.787 . . . . 0.0 109.595 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 CA-C-O 117.988 -1.451 . . . . 0.0 109.541 -179.973 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.2 pt-20 . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 121.32 0.581 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -92.86 158.43 37.81 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.286 -0.884 . . . . 0.0 109.36 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -44.83 117.26 1.44 Allowed 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.699 2.266 . . . . 0.0 112.158 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -147.35 133.54 19.41 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.209 -0.932 . . . . 0.0 109.585 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.32 153.58 20.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.303 -0.873 . . . . 0.0 109.305 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.634 ' SG ' ' N ' ' A' ' 35' ' ' SER . 52.5 t -72.79 179.47 3.63 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.158 -0.964 . . . . 0.0 109.62 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.634 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 3.9 m -80.52 -74.48 0.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.241 -0.912 . . . . 0.0 109.849 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.674 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.8 tp -103.6 91.5 4.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.208 -0.932 . . . . 0.0 109.617 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.674 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 0.9 OUTLIER 154.54 93.58 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.372 -0.83 . . . . 0.0 109.255 179.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -48.39 79.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.748 2.299 . . . . 0.0 112.318 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 1.9 pt20 -153.36 142.48 21.37 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.293 -0.879 . . . . 0.0 109.546 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.74 140.47 48.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.344 -0.848 . . . . 0.0 109.451 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -122.41 172.27 8.46 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.131 -0.981 . . . . 0.0 109.479 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.36 -65.53 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.24 -0.912 . . . . 0.0 109.527 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -96.11 -179.36 4.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.115 -0.991 . . . . 0.0 109.61 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.403 ' O ' ' N ' ' A' ' 48' ' ' THR . 3.5 t80 -79.03 -37.32 39.4 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.227 -0.921 . . . . 0.0 109.448 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.48 ' O ' ' OG1' ' A' ' 48' ' ' THR . 38.9 t -49.61 -50.35 43.18 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.196 -0.94 . . . . 0.0 109.197 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.37 -38.85 74.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.315 -0.866 . . . . 0.0 109.14 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.9 ttt -66.97 -31.84 72.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.346 -0.846 . . . . 0.0 109.278 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -66.3 -51.86 53.1 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.337 -0.852 . . . . 0.0 109.356 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.446 ' O ' ' N ' ' A' ' 53' ' ' THR . 37.6 mmtt -52.43 -41.39 63.21 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.714 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.2 -42.46 63.54 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.603 -0.686 . . . . 0.0 109.253 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.541 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -73.21 -40.53 64.65 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 120.976 -1.078 . . . . 0.0 108.906 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -71.32 -16.82 62.46 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.292 -0.88 . . . . 0.0 108.664 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.447 HG22 ' O ' ' A' ' 50' ' ' HIS . 0.6 OUTLIER -101.85 -5.83 24.31 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.515 -0.74 . . . . 0.0 109.167 179.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.526 ' O ' ' C ' ' A' ' 55' ' ' GLY . 0.1 OUTLIER -41.28 120.87 1.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.349 -0.845 . . . . 0.0 109.503 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.526 ' C ' ' O ' ' A' ' 54' ' ' HIS . . . . . . . . 0 N--CA 1.49 2.288 0 CA-C-O 118.016 -1.436 . . . . 0.0 109.527 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -114.3 86.9 12.65 Favored Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.279 -0.888 . . . . 0.0 109.46 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -78.5 -173.98 2.08 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.748 2.299 . . . . 0.0 112.217 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.84 124.65 26.51 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.226 -0.921 . . . . 0.0 109.577 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.21 170.42 7.92 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.165 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.619 ' SG ' ' N ' ' A' ' 35' ' ' SER . 50.0 t -75.8 -179.39 4.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.167 -0.958 . . . . 0.0 109.603 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.619 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.8 OUTLIER -87.34 -70.57 0.61 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.283 -0.886 . . . . 0.0 109.778 -179.699 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 37.6 tp -110.08 91.77 3.78 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.17 -0.956 . . . . 0.0 109.925 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.682 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.2 p 152.93 103.45 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.427 -0.795 . . . . 0.0 109.175 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -46.3 79.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.583 0 C-N-CA 122.621 2.214 . . . . 0.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.9 OUTLIER -145.14 140.57 28.08 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.277 -0.89 . . . . 0.0 109.483 -179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -119.83 140.18 51.21 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.325 -0.859 . . . . 0.0 109.25 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 32.9 p -141.36 167.64 21.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.139 -0.975 . . . . 0.0 109.592 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -129.97 -49.21 1.12 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.244 -0.91 . . . . 0.0 109.289 179.879 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -98.41 140.8 32.12 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.302 -0.874 . . . . 0.0 109.273 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 48' ' ' THR . 4.3 t80 -52.93 -27.95 21.24 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.162 -0.961 . . . . 0.0 109.557 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.4 OUTLIER -57.8 -43.18 85.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.267 -0.895 . . . . 0.0 109.361 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.95 -36.21 31.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 109.389 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 ttm -68.32 -23.64 64.75 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.245 -0.909 . . . . 0.0 109.354 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.524 HG23 ' O ' ' A' ' 44' ' ' PHE . 4.3 p -71.98 -53.62 12.43 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.239 -0.913 . . . . 0.0 109.312 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.1 mmmt -51.79 -36.57 48.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.68 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.53 -46.4 70.14 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 179.47 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' N ' HD23 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -66.99 -34.71 78.35 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.059 -1.025 . . . . 0.0 108.574 179.744 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -78.58 -22.06 47.68 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.565 ' N ' ' O ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -90.24 -13.73 34.82 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.499 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -38.31 119.36 0.8 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.449 -0.782 . . . . 0.0 109.457 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 CA-C-O 118.028 -1.429 . . . . 0.0 109.535 179.987 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.327 0.584 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 10.0 mttm -116.26 97.61 49.98 Favored Pre-proline 0 N--CA 1.49 1.541 0 O-C-N 121.187 -0.946 . . . . 0.0 109.349 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -77.07 -99.35 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.682 2.254 . . . . 0.0 112.247 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -142.55 109.23 5.4 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.205 -0.934 . . . . 0.0 109.525 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 81.6 p -107.52 163.95 12.63 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.226 -0.921 . . . . 0.0 109.406 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.491 ' SG ' ' N ' ' A' ' 35' ' ' SER . 29.5 t -83.52 -178.07 6.92 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.25 -0.906 . . . . 0.0 109.603 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.491 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.2 OUTLIER -88.55 -77.29 0.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.242 -0.911 . . . . 0.0 109.519 -179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.663 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 26.4 tp -100.18 91.2 4.64 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.212 -0.93 . . . . 0.0 109.263 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.663 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 0.9 OUTLIER 154.96 93.23 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.583 0 O-C-N 121.473 -0.767 . . . . 0.0 109.151 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.39 79.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.806 2.338 . . . . 0.0 112.386 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.789 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 4.1 pt20 -156.15 154.52 31.0 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.127 -0.983 . . . . 0.0 109.628 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.0 mtm-85 -132.88 154.31 50.5 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.318 -0.864 . . . . 0.0 109.485 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -130.44 177.42 7.37 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.18 -0.95 . . . . 0.0 109.461 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.9 mtt180 -126.19 -46.49 1.65 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.291 -0.881 . . . . 0.0 109.392 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.505 ' O ' ' C ' ' A' ' 44' ' ' PHE . 0.4 OUTLIER -116.12 136.03 53.39 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.158 -0.964 . . . . 0.0 109.335 179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.505 ' C ' ' O ' ' A' ' 43' ' ' ASP . 6.5 t80 -38.19 -35.55 0.17 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.179 -0.951 . . . . 0.0 109.438 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.45 ' OG ' ' N ' ' A' ' 46' ' ' ALA . 18.2 p -50.81 -57.26 8.85 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.229 -0.919 . . . . 0.0 109.415 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.45 ' N ' ' OG ' ' A' ' 45' ' ' SER . . . -68.03 -33.82 75.31 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.316 -0.865 . . . . 0.0 109.42 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -66.0 -37.91 87.12 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.283 -0.885 . . . . 0.0 109.447 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.464 HG23 ' CE2' ' A' ' 44' ' ' PHE . 0.1 OUTLIER -63.93 -50.27 69.33 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.267 -0.896 . . . . 0.0 109.555 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 53' ' ' THR . 17.9 mttt -52.95 -42.83 65.83 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.082 -1.011 . . . . 0.0 108.428 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.789 ' CE1' ' NE2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -52.81 -43.02 65.64 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.63 -0.669 . . . . 0.0 109.31 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -73.26 -38.22 66.04 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.039 -1.038 . . . . 0.0 108.992 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -74.03 -17.75 60.93 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.264 -0.897 . . . . 0.0 108.643 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.549 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -101.33 -8.97 21.6 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.447 -0.783 . . . . 0.0 109.092 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.549 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -34.36 102.29 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.467 -0.771 . . . . 0.0 109.475 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.495 ' O ' ' O ' ' A' ' 54' ' ' HIS . . . . . . . . 0 N--CA 1.49 2.271 0 CA-C-O 117.992 -1.449 . . . . 0.0 109.513 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.56 149.88 48.5 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.322 -0.861 . . . . 0.0 109.504 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.569 ' O ' ' N ' ' A' ' 33' ' ' SER . 48.4 Cg_endo -72.73 131.6 17.42 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.722 2.281 . . . . 0.0 112.141 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -62.65 69.74 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.283 -0.886 . . . . 0.0 109.572 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.569 ' N ' ' O ' ' A' ' 31' ' ' PRO . 56.1 p -87.88 153.53 21.25 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.229 -0.919 . . . . 0.0 109.339 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.576 ' SG ' ' N ' ' A' ' 35' ' ' SER . 45.9 t -77.79 -177.72 5.04 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.268 -0.895 . . . . 0.0 109.617 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.576 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 35.6 t -91.26 -63.69 1.23 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.216 -0.927 . . . . 0.0 109.491 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.709 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 0.7 OUTLIER -109.62 91.32 3.6 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.151 -0.968 . . . . 0.0 109.58 -179.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.709 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.5 p 150.81 94.34 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.493 -0.754 . . . . 0.0 109.134 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -47.05 75.92 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.719 2.279 . . . . 0.0 112.126 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.692 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 5.8 pt20 -148.89 146.14 27.77 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.297 -0.877 . . . . 0.0 109.505 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -123.0 143.81 49.68 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.345 -0.847 . . . . 0.0 109.495 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.5 p -130.4 -169.98 2.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.293 -0.88 . . . . 0.0 109.504 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.02 -49.94 0.17 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -0.92 . . . . 0.0 109.619 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.34 137.49 40.53 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.27 -0.894 . . . . 0.0 109.466 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.678 ' CD2' ' CG2' ' A' ' 48' ' ' THR . 2.3 t80 -45.17 -40.03 6.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.897 . . . . 0.0 109.432 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.0 -42.34 48.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.288 -0.883 . . . . 0.0 109.499 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.2 -32.92 22.4 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.241 -0.912 . . . . 0.0 109.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.3 ttp -74.77 -23.56 58.55 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.343 -0.848 . . . . 0.0 109.37 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.678 ' CG2' ' CD2' ' A' ' 44' ' ' PHE . 26.0 p -76.44 -50.48 13.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.213 -0.929 . . . . 0.0 109.524 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 53' ' ' THR . 18.3 mttt -51.55 -38.52 54.68 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.719 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.81 -47.03 71.27 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.52 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.491 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -72.87 -34.83 66.97 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.071 -1.018 . . . . 0.0 108.643 179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.46 -15.21 60.44 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.668 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.7 OUTLIER -109.38 -0.51 18.98 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.57 -0.706 . . . . 0.0 109.214 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.458 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -41.37 -15.52 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.272 -0.893 . . . . 0.0 109.458 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.668 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.491 2.308 0 CA-C-O 117.994 -1.448 . . . . 0.0 109.537 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 121.335 0.588 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.409 ' HD3' ' N ' ' A' ' 30' ' ' LYS . 0.5 OUTLIER -68.29 149.51 98.05 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.3 -0.875 . . . . 0.0 109.531 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -72.62 141.6 34.7 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 122.843 2.362 . . . . 0.0 112.171 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -106.13 101.52 11.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.304 -0.873 . . . . 0.0 109.557 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.87 152.14 18.63 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.161 -0.962 . . . . 0.0 109.368 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.53 ' SG ' ' N ' ' A' ' 35' ' ' SER . 37.7 t -77.75 -176.25 4.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 109.543 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.53 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 48.4 t -91.78 -72.4 0.59 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.338 -0.851 . . . . 0.0 109.391 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.682 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 8.3 tt -102.79 91.76 4.31 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.181 -0.95 . . . . 0.0 109.34 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.682 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.4 p 151.66 92.1 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.615 -0.678 . . . . 0.0 109.206 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -46.53 79.4 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.721 2.281 . . . . 0.0 112.283 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.545 ' N ' ' O ' ' A' ' 37' ' ' CYS . 10.6 pt20 -151.29 141.66 22.43 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.222 -0.924 . . . . 0.0 109.444 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.435 ' CZ ' ' HB2' ' A' ' 40' ' ' ARG . 7.9 mtp-105 -125.18 131.95 53.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.196 -0.94 . . . . 0.0 109.586 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.85 150.02 29.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.337 -0.852 . . . . 0.0 109.24 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -89.38 -19.31 25.36 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.184 -0.947 . . . . 0.0 109.543 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.3 144.5 34.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.246 -0.909 . . . . 0.0 109.435 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -58.03 -35.31 71.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.308 -0.87 . . . . 0.0 109.568 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.6 p -49.42 -39.5 33.02 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.222 -0.924 . . . . 0.0 109.178 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.66 -27.75 25.17 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.291 -0.881 . . . . 0.0 109.07 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.5 ttt -70.09 -28.05 65.1 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.339 -0.85 . . . . 0.0 109.142 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.6 p -67.31 -51.47 52.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.204 -0.935 . . . . 0.0 109.155 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 53' ' ' THR . 11.1 mttt -53.33 -38.97 63.71 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.72 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.92 -42.05 68.36 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.602 -0.686 . . . . 0.0 109.168 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.575 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.3 OUTLIER -72.88 -39.97 65.98 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.048 -1.033 . . . . 0.0 108.844 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.407 ' HG2' ' NH1' ' A' ' 52' ' ' ARG . 5.2 tpp85 -73.08 -16.7 61.47 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.539 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -103.83 -5.49 22.35 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.448 -0.783 . . . . 0.0 109.091 179.671 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.539 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -34.15 149.0 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.483 -0.761 . . . . 0.0 109.631 -179.775 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 CA-C-O 118.032 -1.427 . . . . 0.0 109.543 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.409 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 66.3 tt0 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.637 ' C ' ' H ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -72.74 113.96 26.04 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 109.418 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.409 ' HD3' ' O ' ' A' ' 29' ' ' GLU . 50.0 Cg_exo -49.39 5.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.577 2.184 . . . . 0.0 112.282 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.637 ' H ' ' C ' ' A' ' 30' ' ' LYS . 4.3 m-85 -110.34 69.25 0.69 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.241 -0.912 . . . . 0.0 109.665 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.9 158.71 16.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.227 -0.921 . . . . 0.0 109.3 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.617 ' SG ' ' N ' ' A' ' 35' ' ' SER . 51.3 t -73.02 -179.15 3.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.163 -0.961 . . . . 0.0 109.625 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.617 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.6 OUTLIER -89.65 -48.42 7.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.324 -0.86 . . . . 0.0 109.57 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 62.5 tp -127.47 91.47 3.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.221 -0.924 . . . . 0.0 109.614 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.69 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.6 p 150.01 134.64 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.731 0 O-C-N 121.592 -0.693 . . . . 0.0 109.146 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.4 76.61 3.1 Favored 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.703 2.269 . . . . 0.0 112.313 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.682 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 14.0 pt20 -151.54 142.75 23.27 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.187 -0.946 . . . . 0.0 109.424 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.564 ' HD3' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -122.24 150.45 42.28 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.351 -0.843 . . . . 0.0 109.485 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 p -125.9 -172.23 2.56 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.238 -0.914 . . . . 0.0 109.497 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -117.48 -59.53 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.175 -0.953 . . . . 0.0 109.457 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -112.98 163.41 14.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.273 -0.892 . . . . 0.0 109.413 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.511 ' O ' HG23 ' A' ' 48' ' ' THR . 18.3 t80 -62.16 -32.98 73.66 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.308 -0.87 . . . . 0.0 109.348 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.55 ' O ' ' OG1' ' A' ' 48' ' ' THR . 2.3 p -53.5 -45.2 69.59 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.293 -0.879 . . . . 0.0 109.419 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.78 -42.3 28.25 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -0.896 . . . . 0.0 109.4 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.8 ttt -58.81 -27.38 65.01 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.412 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 45' ' ' SER . 7.9 p -68.25 -50.76 51.73 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.211 -0.93 . . . . 0.0 109.463 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 53' ' ' THR . 2.0 mtpt -52.68 -38.55 60.75 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.699 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.9 -43.7 77.52 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.674 -0.641 . . . . 0.0 109.287 179.68 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.58 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -70.82 -36.94 73.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.987 -1.071 . . . . 0.0 108.892 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -76.1 -23.28 54.95 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.562 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -94.76 -8.3 37.98 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.471 -0.768 . . . . 0.0 109.139 179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.562 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -33.27 -53.56 0.39 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.342 -0.849 . . . . 0.0 109.512 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.296 0 CA-C-O 117.986 -1.452 . . . . 0.0 109.597 -179.985 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.449 ' N ' ' CD ' ' A' ' 29' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.07 149.46 73.8 Favored Pre-proline 0 N--CA 1.49 1.531 0 O-C-N 121.259 -0.901 . . . . 0.0 109.38 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -67.59 149.05 79.39 Favored 'Trans proline' 0 C--N 1.306 -1.706 0 C-N-CA 122.762 2.308 . . . . 0.0 111.985 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -124.21 134.44 53.27 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.629 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -92.65 165.68 12.86 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.313 -0.867 . . . . 0.0 109.212 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.746 ' SG ' ' N ' ' A' ' 35' ' ' SER . 35.6 t -74.51 -179.78 4.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.143 -0.973 . . . . 0.0 109.592 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.746 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.4 OUTLIER -84.55 -44.38 13.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.341 -0.849 . . . . 0.0 109.712 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.685 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 6.1 tt -136.94 92.05 2.69 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.111 -0.993 . . . . 0.0 109.992 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.685 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.3 p 152.36 139.1 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.441 -0.787 . . . . 0.0 109.273 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.18 75.79 2.76 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.721 2.281 . . . . 0.0 112.255 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.695 ' OE1' ' CE1' ' A' ' 50' ' ' HIS . 7.3 pt20 -150.79 140.66 21.88 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.139 -0.975 . . . . 0.0 109.516 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.519 ' HD2' ' H ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -128.71 153.63 47.14 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.211 -0.93 . . . . 0.0 109.473 179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.41 162.83 33.44 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.205 -0.935 . . . . 0.0 109.49 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtp85 -103.07 -35.13 8.63 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.171 -0.956 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -124.38 140.77 52.64 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.257 -0.902 . . . . 0.0 109.443 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -47.71 -33.97 7.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.261 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.552 ' O ' ' OG1' ' A' ' 48' ' ' THR . 53.6 p -49.53 -55.53 13.05 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.264 -0.897 . . . . 0.0 109.212 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.68 -28.55 63.8 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.301 -0.874 . . . . 0.0 109.185 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.452 ' O ' ' CD1' ' A' ' 51' ' ' LEU . 10.3 ttt -72.11 -25.48 61.76 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.277 -0.89 . . . . 0.0 109.255 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.552 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.7 OUTLIER -72.0 -48.85 41.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.184 -0.947 . . . . 0.0 109.371 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 53' ' ' THR . 7.4 mmtp -51.89 -37.85 53.95 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.71 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.32 -48.47 65.4 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.668 ' N ' HD12 ' A' ' 51' ' ' LEU . 7.3 mp -64.24 -38.96 92.93 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.009 -1.057 . . . . 0.0 108.618 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -73.84 -20.32 60.48 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.53 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -97.98 -9.43 26.14 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.466 -0.771 . . . . 0.0 109.114 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.53 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -34.96 -53.35 0.57 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.423 -0.798 . . . . 0.0 109.364 180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.973 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.6 pttm -130.28 150.55 76.47 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.234 -0.917 . . . . 0.0 109.456 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -42.75 117.93 1.03 Allowed 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.79 2.327 . . . . 0.0 112.287 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -69.5 126.1 28.73 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.295 -0.878 . . . . 0.0 109.431 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.93 156.49 23.9 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.25 -0.906 . . . . 0.0 109.536 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.71 ' SG ' ' N ' ' A' ' 35' ' ' SER . 35.1 t -73.83 178.81 4.61 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 109.512 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.71 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -70.26 -81.69 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.274 -0.891 . . . . 0.0 109.704 -179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.661 ' C ' ' SG ' ' A' ' 37' ' ' CYS . 33.7 tp -102.1 91.67 4.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.273 -0.892 . . . . 0.0 109.566 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.661 ' SG ' ' C ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER 156.82 94.16 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.413 -0.804 . . . . 0.0 109.283 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -47.93 79.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.726 2.284 . . . . 0.0 112.317 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.566 ' OE1' ' O ' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -146.84 134.56 21.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.209 -0.932 . . . . 0.0 109.482 179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.74 133.62 53.85 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.234 -0.916 . . . . 0.0 109.564 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.71 162.63 19.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.96 . . . . 0.0 109.441 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.502 ' O ' ' OD1' ' A' ' 43' ' ' ASP . 19.1 ttt-85 -118.59 -6.8 10.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.269 -0.894 . . . . 0.0 109.545 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.502 ' OD1' ' O ' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -146.4 163.28 36.1 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.198 -0.939 . . . . 0.0 109.487 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.455 ' CE2' HG23 ' A' ' 48' ' ' THR . 23.2 t80 -71.24 -39.99 71.31 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.577 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.7 OUTLIER -49.68 -55.58 13.28 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.293 179.947 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.95 -29.55 70.48 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.224 -0.923 . . . . 0.0 109.127 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 16.3 ttt -73.89 -32.5 63.62 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.392 -0.817 . . . . 0.0 109.334 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.577 ' OG1' ' O ' ' A' ' 45' ' ' SER . 0.8 OUTLIER -64.28 -53.05 55.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.259 -0.9 . . . . 0.0 109.358 179.949 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' A' ' 53' ' ' THR . 38.9 mttm -54.23 -37.81 65.02 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.19 -0.944 . . . . 0.0 108.486 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.706 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.81 -40.92 73.41 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.636 -0.665 . . . . 0.0 109.297 179.638 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.571 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -72.54 -37.61 68.25 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.04 -1.037 . . . . 0.0 108.917 179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.5 mtm180 -76.29 -22.64 54.8 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.568 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -93.59 -10.91 33.08 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.532 -0.73 . . . . 0.0 109.039 179.639 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.568 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -31.51 -83.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.399 -0.813 . . . . 0.0 109.645 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' A' ' 54' ' ' HIS . . . . . . . . 0 N--CA 1.489 2.21 0 CA-C-O 117.923 -1.487 . . . . 0.0 109.55 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.552 ' N ' ' OE1' ' A' ' 29' ' ' GLU . 25.2 mp0 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' O ' ' N ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -89.91 153.41 47.27 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.3 -0.875 . . . . 0.0 109.459 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -42.23 87.82 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.85 2.367 . . . . 0.0 112.148 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.456 ' N ' ' O ' ' A' ' 30' ' ' LYS . 1.6 m-85 -83.61 121.17 26.89 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.248 -0.908 . . . . 0.0 109.608 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.45 159.0 17.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.292 -0.88 . . . . 0.0 109.374 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.588 ' SG ' ' N ' ' A' ' 35' ' ' SER . 42.5 t -77.64 -178.62 5.42 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.193 -0.942 . . . . 0.0 109.547 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.588 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 91.7 p -85.86 -67.23 0.82 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.681 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 31.0 tp -111.56 92.8 4.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.172 -0.955 . . . . 0.0 109.675 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.681 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.3 p 152.59 97.13 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.483 -0.761 . . . . 0.0 109.315 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -48.02 76.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.657 2.238 . . . . 0.0 112.308 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.7 ' OE1' ' CG ' ' A' ' 50' ' ' HIS . 3.5 pt20 -151.54 141.44 22.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.245 -0.909 . . . . 0.0 109.461 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.3 mtt180 -117.18 162.54 17.7 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.263 -0.898 . . . . 0.0 109.725 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.558 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 6.5 p -145.0 150.72 37.39 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.292 -0.88 . . . . 0.0 109.494 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -90.18 -46.5 8.4 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.238 -0.914 . . . . 0.0 109.35 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.16 161.52 17.04 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.279 -0.888 . . . . 0.0 109.345 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' O ' HG23 ' A' ' 48' ' ' THR . 6.2 t80 -67.36 -34.05 76.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 109.388 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.575 ' O ' ' OG1' ' A' ' 48' ' ' THR . 7.6 t -49.71 -57.48 7.17 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.919 . . . . 0.0 109.201 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.74 -34.41 77.82 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.315 -0.866 . . . . 0.0 109.142 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.558 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 2.7 ttt -69.26 -29.4 67.29 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.32 -0.863 . . . . 0.0 109.433 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.618 HG23 ' O ' ' A' ' 44' ' ' PHE . 38.1 p -69.66 -49.17 56.18 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.209 -0.932 . . . . 0.0 109.408 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' O ' ' N ' ' A' ' 53' ' ' THR . 9.0 mttm -51.79 -40.08 59.77 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.7 ' CG ' ' OE1' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -52.32 -49.0 65.12 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 51' ' ' LEU . 9.9 mp -56.42 -46.8 80.05 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.151 -0.968 . . . . 0.0 108.756 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.18 -18.24 62.49 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.664 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.5 OUTLIER -98.75 -5.26 31.7 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.443 -0.785 . . . . 0.0 109.065 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.558 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -32.92 -30.41 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.366 -0.834 . . . . 0.0 109.365 -179.846 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.664 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.47 149.77 47.4 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.867 . . . . 0.0 109.403 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -68.69 130.87 21.52 Favored 'Trans proline' 0 C--N 1.304 -1.775 0 C-N-CA 122.831 2.354 . . . . 0.0 112.055 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -57.45 115.52 2.79 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.312 -0.867 . . . . 0.0 109.626 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.7 p -79.31 170.24 16.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.34 -0.85 . . . . 0.0 109.362 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.757 ' SG ' ' N ' ' A' ' 35' ' ' SER . 19.6 t -81.07 179.02 8.05 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.207 -0.933 . . . . 0.0 109.723 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.757 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -78.79 -51.53 9.63 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.344 -0.847 . . . . 0.0 109.711 -179.872 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.713 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 4.5 tt -136.86 99.04 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.115 -0.991 . . . . 0.0 109.76 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.713 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.7 p 148.34 143.76 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.618 -0.676 . . . . 0.0 109.199 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -74.86 74.3 3.97 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.654 2.236 . . . . 0.0 112.34 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.665 ' NE2' ' CE1' ' A' ' 50' ' ' HIS . 6.1 pt20 -152.88 148.99 27.8 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -136.01 148.1 48.26 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.179 -0.951 . . . . 0.0 109.658 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 p -128.31 164.95 21.51 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.443 -0.786 . . . . 0.0 109.486 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.83 -46.87 4.56 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.168 -0.958 . . . . 0.0 109.379 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -112.88 159.49 18.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.365 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.734 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 22.7 t80 -59.63 -36.75 76.98 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.244 -0.91 . . . . 0.0 109.515 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.569 ' O ' ' OG1' ' A' ' 48' ' ' THR . 0.5 OUTLIER -49.72 -58.85 4.51 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 109.35 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.65 -33.21 75.4 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.356 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -28.62 63.01 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.277 -0.889 . . . . 0.0 109.314 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.734 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 1.6 p -71.13 -52.09 21.27 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.24 -0.913 . . . . 0.0 109.451 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.439 ' O ' ' N ' ' A' ' 53' ' ' THR . 13.6 mttt -52.04 -40.03 60.47 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.131 -0.981 . . . . 0.0 108.379 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.701 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -52.41 -43.9 65.06 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.692 -0.63 . . . . 0.0 109.309 179.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.506 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -67.93 -40.3 83.35 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.09 -1.007 . . . . 0.0 108.727 179.869 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -72.87 -19.2 61.34 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.447 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.5 OUTLIER -100.67 -4.27 28.65 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.447 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -40.18 147.49 0.1 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.373 -0.829 . . . . 0.0 109.489 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 CA-C-O 117.969 -1.462 . . . . 0.0 109.475 179.877 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.301 0.572 . . . . 0.0 109.487 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -102.9 152.05 38.45 Favored Pre-proline 0 N--CA 1.49 1.555 0 O-C-N 121.206 -0.934 . . . . 0.0 109.5 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -40.99 132.94 2.8 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 122.798 2.332 . . . . 0.0 112.219 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.73 110.07 14.48 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.218 -0.926 . . . . 0.0 109.667 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.7 152.43 26.55 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.333 -0.854 . . . . 0.0 109.114 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.508 ' SG ' ' N ' ' A' ' 35' ' ' SER . 38.2 t -76.11 -179.18 4.82 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.072 -1.018 . . . . 0.0 109.636 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.508 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 18.2 m -82.87 -89.16 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.356 -0.84 . . . . 0.0 109.486 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.673 HD23 ' C ' ' A' ' 36' ' ' LEU . 7.4 tt -91.25 91.12 8.05 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.169 -0.957 . . . . 0.0 109.106 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.663 ' SG ' ' C ' ' A' ' 36' ' ' LEU . 0.8 OUTLIER 158.55 91.81 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.501 -0.749 . . . . 0.0 109.088 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_exo -46.8 79.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.95 2.433 . . . . 0.0 112.475 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.523 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -148.93 136.55 20.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.195 -0.94 . . . . 0.0 109.552 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.8 mtp180 -127.62 126.84 42.77 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.285 -0.884 . . . . 0.0 109.38 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.607 ' OG ' ' SD ' ' A' ' 47' ' ' MET . 1.4 p -116.06 -167.2 1.23 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.949 . . . . 0.0 109.715 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.8 mmt-85 -128.0 -47.17 1.37 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.33 -0.856 . . . . 0.0 109.319 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -113.74 174.07 6.11 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.34 -0.85 . . . . 0.0 109.293 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.528 ' CD2' HG23 ' A' ' 48' ' ' THR . 0.4 OUTLIER -75.05 -33.82 61.78 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.239 -0.913 . . . . 0.0 109.495 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.9 m -52.22 -43.37 64.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.261 -0.9 . . . . 0.0 109.484 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -85.98 -35.03 20.67 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.364 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.607 ' SD ' ' OG ' ' A' ' 41' ' ' SER . 1.8 tpt -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.222 -0.924 . . . . 0.0 109.398 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 44' ' ' PHE . 1.4 p -69.05 -46.05 68.85 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.223 -0.923 . . . . 0.0 109.41 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.4 mttt -53.01 -38.66 62.54 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.755 ' C ' ' ND1' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -53.42 -45.9 69.56 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.569 -0.707 . . . . 0.0 109.348 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.68 ' N ' HD12 ' A' ' 51' ' ' LEU . 7.1 mp -66.46 -39.59 88.91 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.046 -1.034 . . . . 0.0 108.873 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -74.65 -19.33 60.32 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.374 -0.828 . . . . 0.0 108.844 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.56 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.6 OUTLIER -96.61 -12.04 24.49 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.413 -0.804 . . . . 0.0 109.01 179.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.56 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -31.18 -41.23 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.501 -0.749 . . . . 0.0 109.511 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.496 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.491 2.315 0 CA-C-O 117.97 -1.461 . . . . 0.0 109.512 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -49.52 143.92 9.83 Favored Pre-proline 0 N--CA 1.49 1.539 0 O-C-N 121.276 -0.89 . . . . 0.0 109.42 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.81 151.96 52.0 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.781 2.32 . . . . 0.0 112.197 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -149.14 165.83 30.61 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.263 -0.898 . . . . 0.0 109.5 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.73 158.4 23.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.258 -0.902 . . . . 0.0 109.431 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.589 ' SG ' ' N ' ' A' ' 35' ' ' SER . 42.7 t -69.79 -176.75 1.12 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.199 -0.938 . . . . 0.0 109.397 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -86.77 -65.03 1.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.29 -0.881 . . . . 0.0 109.457 -179.927 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.668 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 60.3 tp -114.79 91.82 3.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.248 -0.908 . . . . 0.0 109.514 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.668 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 0.9 OUTLIER 154.72 101.27 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.364 -0.835 . . . . 0.0 109.323 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -47.99 72.26 0.01 OUTLIER 'Trans proline' 0 C--N 1.307 -1.633 0 C-N-CA 122.676 2.251 . . . . 0.0 112.212 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.64 ' N ' ' O ' ' A' ' 37' ' ' CYS . 0.0 OUTLIER -140.17 147.74 40.57 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.421 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm-85 -121.52 145.19 48.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.22 -0.925 . . . . 0.0 109.599 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.51 140.15 42.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.315 -0.866 . . . . 0.0 109.39 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.495 ' CG ' ' N ' ' A' ' 43' ' ' ASP . 5.9 ptp180 -95.97 -42.45 8.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.254 -0.904 . . . . 0.0 109.561 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.495 ' N ' ' CG ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -115.07 161.8 17.88 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.292 -0.88 . . . . 0.0 109.468 -179.926 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.574 ' CE2' ' CG2' ' A' ' 48' ' ' THR . 32.1 t80 -65.42 -33.37 75.79 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.282 -0.886 . . . . 0.0 109.283 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.453 ' O ' ' OG1' ' A' ' 48' ' ' THR . 5.7 m -50.04 -50.91 46.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.348 -0.845 . . . . 0.0 109.37 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -75.57 -28.06 58.82 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.241 -0.912 . . . . 0.0 109.398 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.546 ' O ' HD21 ' A' ' 51' ' ' LEU . 8.0 ttt -72.22 -22.53 61.25 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.284 -0.885 . . . . 0.0 109.339 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.574 ' CG2' ' CE2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -77.09 -53.31 7.94 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.209 -0.932 . . . . 0.0 109.536 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' A' ' 53' ' ' THR . 32.3 mttt -52.06 -38.59 57.61 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.166 -0.959 . . . . 0.0 108.48 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.699 ' ND1' ' C ' ' A' ' 50' ' ' HIS . 0.0 OUTLIER -55.45 -43.86 75.81 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.606 -0.684 . . . . 0.0 109.282 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.546 HD21 ' O ' ' A' ' 47' ' ' MET . 0.1 OUTLIER -73.43 -32.25 64.29 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.068 -1.02 . . . . 0.0 109.01 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.52 -31.08 53.22 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.669 ' O ' ' N ' ' A' ' 55' ' ' GLY . 0.8 OUTLIER -84.35 -15.04 47.88 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.497 -0.752 . . . . 0.0 109.128 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.504 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -35.3 89.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 109.469 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.669 ' N ' ' O ' ' A' ' 53' ' ' THR . . . . . . . . 0 N--CA 1.489 2.219 0 CA-C-O 118.027 -1.43 . . . . 0.0 109.594 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.414 ' O ' ' C ' ' A' ' 30' ' ' LYS . 4.7 mt-10 . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.486 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 6.5 pttp -44.38 152.86 0.48 Allowed Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.293 -0.88 . . . . 0.0 109.36 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -43.36 155.17 0.16 Allowed 'Trans proline' 0 C--N 1.307 -1.633 0 C-N-CA 122.734 2.289 . . . . 0.0 112.044 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.486 ' CD1' ' O ' ' A' ' 30' ' ' LYS . 27.1 m-85 -131.07 82.96 2.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.266 -0.896 . . . . 0.0 109.441 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.85 161.38 18.34 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.342 -0.849 . . . . 0.0 109.49 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.718 ' SG ' ' N ' ' A' ' 35' ' ' SER . 35.5 t -72.62 179.74 3.42 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.221 -0.924 . . . . 0.0 109.346 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.718 ' N ' ' SG ' ' A' ' 34' ' ' CYS . 0.1 OUTLIER -82.91 -43.09 16.92 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.159 -0.963 . . . . 0.0 109.751 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.69 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 1.0 OUTLIER -137.08 91.86 2.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.074 -1.016 . . . . 0.0 110.051 -179.8 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.69 ' SG ' ' O ' ' A' ' 36' ' ' LEU . 1.2 p 153.14 137.52 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.696 0 O-C-N 121.437 -0.789 . . . . 0.0 109.527 179.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.88 71.92 2.67 Favored 'Trans proline' 0 C--N 1.307 -1.63 0 C-N-CA 122.756 2.304 . . . . 0.0 112.209 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.873 HE21 ' CD2' ' A' ' 50' ' ' HIS . 9.2 pt20 -153.43 163.26 40.25 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.25 -0.906 . . . . 0.0 109.349 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -140.8 146.81 38.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.247 -0.908 . . . . 0.0 109.683 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.64 159.18 32.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.32 -0.862 . . . . 0.0 109.471 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.488 HH11 ' HD2' ' A' ' 42' ' ' ARG . 24.4 mtm105 -90.17 -72.77 0.55 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 109.505 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.25 153.63 19.14 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.537 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.596 ' CD2' HG23 ' A' ' 48' ' ' THR . 7.0 t80 -58.72 -35.56 72.88 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.178 -0.951 . . . . 0.0 109.32 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -44.8 45.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 109.141 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.48 -33.12 48.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.357 -0.839 . . . . 0.0 109.097 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -28.12 63.51 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.313 -0.867 . . . . 0.0 109.255 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.596 HG23 ' CD2' ' A' ' 44' ' ' PHE . 3.4 p -70.59 -52.18 23.26 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.296 -0.877 . . . . 0.0 109.309 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -51.99 -39.06 58.81 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.873 ' CD2' HE21 ' A' ' 39' ' ' GLN . 0.0 OUTLIER -51.9 -44.5 63.82 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.415 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 1.9 mt -61.28 -45.53 94.12 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.141 -0.974 . . . . 0.0 108.931 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.0 mtp180 -71.08 -19.51 62.46 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.582 ' O ' ' C ' ' A' ' 54' ' ' HIS . 0.4 OUTLIER -100.01 -5.0 28.81 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.582 ' C ' ' O ' ' A' ' 53' ' ' THR . 0.2 OUTLIER -31.1 -51.73 0.18 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 109.636 -179.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 CA-C-O 118.041 -1.422 . . . . 0.0 109.567 179.962 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_