data_1wm4_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 1wm4 _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 ' 3' ' ' THR . . . . . 0.579 ' OG1' ' NZ ' ' A' ' 93' ' ' LYS . 19.7 m . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.28 118.36 18.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.415 -0.803 . . . . 0.0 109.079 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -107.57 139.62 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.333 -0.854 . . . . 0.0 109.89 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.591 ' O ' ' N ' ' A' ' 8' ' ' GLU . 46.9 t0 -100.54 35.71 2.07 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.273 -0.892 . . . . 0.0 108.989 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.636 ' HZ1' ' CA ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -43.63 -16.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.933 . . . . 0.0 109.4 -179.62 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.636 ' CA ' ' HZ1' ' A' ' 7' ' ' LYS . 5.3 tt0 -54.11 -40.54 67.39 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.168 -0.957 . . . . 0.0 108.823 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -68.22 -63.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.384 -0.822 . . . . 0.0 108.804 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.658 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.2 m -44.65 -53.28 7.38 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.294 -0.879 . . . . 0.0 109.009 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 10' ' ' CYS . 20.6 ttt180 -43.55 -59.73 2.05 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.099 -1.0 . . . . 0.0 109.456 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.42 -40.79 2.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.389 -0.819 . . . . 0.0 109.556 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.533 ' O ' ' CG2' ' A' ' 17' ' ' VAL . . . -86.46 -35.9 19.38 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.088 -1.008 . . . . 0.0 110.018 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.731 ' HH ' ' H ' ' A' ' 107' ' ' ASN . 1.2 t80 -45.44 -67.95 0.24 Allowed 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.431 -0.793 . . . . 0.0 110.36 -179.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.643 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 0.4 OUTLIER -75.69 -32.74 60.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.356 -0.84 . . . . 0.0 110.746 -178.72 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.587 ' C ' ' H ' ' A' ' 18' ' ' ARG . 12.6 tp -69.13 -27.89 65.97 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.749 -1.22 . . . . 0.0 109.146 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.533 ' CG2' ' O ' ' A' ' 13' ' ' ALA . 22.5 t -58.66 -1.65 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.587 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.592 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.407 ' O ' ' CG1' ' A' ' 24' ' ' VAL . 6.9 p -46.44 91.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.992 -1.067 . . . . 0.0 108.932 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.5 tt -43.98 -54.07 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 121.25 -0.906 . . . . 0.0 109.7 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.631 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 41.8 p-90 -143.99 166.71 24.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.505 -1.372 . . . . 0.0 111.498 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.1 m -136.34 138.84 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.602 -0.686 . . . . 0.0 109.4 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.8 p -125.87 141.14 52.13 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.308 -0.87 . . . . 0.0 110.173 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.658 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.21 160.89 25.6 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.65 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -137.87 146.69 43.69 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 121.243 -0.911 . . . . 0.0 109.59 -179.598 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.574 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 4.7 m-85 -59.75 98.5 0.05 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.462 -0.774 . . . . 0.0 110.019 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.574 ' N ' ' OD1' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -94.97 102.16 13.97 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.375 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.97 -119.84 7.0 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.2 26.89 10.1 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.325 -1.103 . . . . 0.0 110.615 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.3 m -145.57 151.17 37.7 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.854 -1.154 . . . . 0.0 110.686 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.473 ' CD1' ' N ' ' A' ' 36' ' ' ILE . 1.8 mp -101.55 107.22 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -135.7 151.81 74.95 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.292 -0.88 . . . . 0.0 110.018 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.2 Cg_exo -31.88 139.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 123.069 2.513 . . . . 0.0 112.391 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.12 -35.56 0.21 Allowed Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.578 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.7 m-20 -142.71 -179.02 6.07 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.806 -0.82 . . . . 0.0 108.878 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.778 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -159.25 -170.19 2.89 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.368 -0.832 . . . . 0.0 110.138 -179.778 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.18 140.62 6.31 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.42 -4.78 15.4 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.04 175.22 13.79 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.492 ' OH ' ' O ' ' A' ' 120' ' ' LEU . 1.3 t80 -72.18 -46.29 56.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 120.996 -1.065 . . . . 0.0 109.355 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 45' ' ' TYR . 14.6 mm-40 -42.22 -29.38 0.24 Allowed 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.294 -0.879 . . . . 0.0 110.077 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.709 ' CE1' HE22 ' A' ' 41' ' ' GLN . 2.7 t-160 -66.62 -47.91 71.14 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.073 -1.017 . . . . 0.0 109.135 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -42.97 -28.0 0.23 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.478 ' C ' ' H ' ' A' ' 51' ' ' GLN . 1.9 mt -75.39 -45.56 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.371 -0.83 . . . . 0.0 110.605 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -81.4 8.34 9.55 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 179.064 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.578 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -119.82 -22.3 6.86 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.257 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.449 ' O ' ' CG2' ' A' ' 53' ' ' THR . 0.1 OUTLIER -69.35 141.08 54.29 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.206 -0.934 . . . . 0.0 109.298 179.73 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.458 ' C ' ' H ' ' A' ' 55' ' ' ASP . 33.0 p -157.43 114.19 2.97 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.594 -0.842 . . . . 0.0 110.741 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.569 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.5 OUTLIER -64.11 -0.53 1.21 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.458 ' H ' ' C ' ' A' ' 53' ' ' THR . 10.1 m-20 -110.12 19.12 19.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.448 -0.783 . . . . 0.0 109.373 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' OG1' ' A' ' 53' ' ' THR . 0.3 OUTLIER -144.13 166.18 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.0 110.158 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.704 HH12 ' N ' ' A' ' 91' ' ' ARG . 8.4 ptp180 -136.92 136.43 38.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.803 -0.759 . . . . 0.0 109.885 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.473 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.8 pp -172.31 166.59 5.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.395 -0.816 . . . . 0.0 109.692 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -100.01 156.9 16.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.056 -1.028 . . . . 0.0 108.801 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.434 ' N ' ' O ' ' A' ' 79' ' ' ILE . . . -127.64 152.62 47.45 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.187 -0.946 . . . . 0.0 108.99 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.576 ' CZ ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -146.19 96.11 2.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.283 -0.886 . . . . 0.0 109.254 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -121.3 151.64 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.074 -1.016 . . . . 0.0 109.76 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 1.066 ' CZ ' ' HG ' ' A' ' 74' ' ' SER . 12.5 ttp180 -92.68 117.57 30.13 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -99.44 155.71 17.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.178 -0.951 . . . . 0.0 110.142 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 m -77.77 146.57 35.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.42 -0.8 . . . . 0.0 108.975 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.49 -179.955 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 1.066 ' HG ' ' CZ ' ' A' ' 63' ' ' ARG . 1.2 m . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tptp -105.3 161.84 13.94 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.353 -0.842 . . . . 0.0 109.711 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -133.09 124.46 27.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.429 -0.794 . . . . 0.0 109.449 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.92 159.39 43.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.839 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.768 ' C ' HD12 ' A' ' 79' ' ' ILE . 8.6 tp -111.25 150.04 30.16 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.768 HD12 ' C ' ' A' ' 78' ' ' LEU . 1.5 mp -128.97 144.03 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.998 -1.064 . . . . 0.0 109.329 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.7 m -105.19 137.25 43.27 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.877 . . . . 0.0 109.944 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.2 t-105 -114.76 110.62 19.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.392 -0.817 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -105.95 93.49 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.16 -0.962 . . . . 0.0 109.119 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.93 155.73 29.84 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 54' ' ' ASP . 5.6 tp10 -105.92 42.9 1.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.458 -1.025 . . . . 0.0 109.521 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -161.84 19.17 0.11 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.167 -0.958 . . . . 0.0 109.613 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -92.41 164.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.089 -1.007 . . . . 0.0 109.63 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.431 ' H ' ' HG ' ' A' ' 87' ' ' SER . 1.7 p -67.7 169.92 8.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.43 -0.794 . . . . 0.0 109.703 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.28 -16.65 66.35 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.3 mt -61.4 -70.24 0.2 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 110.347 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.41 ' HB2' HH11 ' A' ' 57' ' ' ARG . 1.4 mt-30 -52.4 -26.99 14.0 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.366 -0.834 . . . . 0.0 109.924 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.704 ' N ' HH12 ' A' ' 57' ' ' ARG . 0.5 OUTLIER -52.39 -59.5 4.35 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.046 . . . . 0.0 109.744 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.46 -23.31 66.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 109.823 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.579 ' NZ ' ' OG1' ' A' ' 3' ' ' THR . 4.0 tptp -74.91 -48.47 24.54 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.132 -0.98 . . . . 0.0 109.228 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.574 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 13.2 m -46.01 -45.93 16.18 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.218 -0.926 . . . . 0.0 109.27 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -54.53 -58.54 12.79 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.129 -1.188 . . . . 0.0 110.129 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 88.2 m -64.76 -47.31 78.64 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.037 -1.272 . . . . 0.0 111.132 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -71.95 -43.63 64.89 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.771 -1.205 . . . . 0.0 111.612 -177.574 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -54.58 -26.19 30.85 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.668 -1.27 . . . . 0.0 109.127 -179.433 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -27.36 41.54 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -0.879 . . . . 0.0 108.639 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mt -68.82 -59.22 3.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.508 -0.745 . . . . 0.0 109.607 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.0 p -62.46 -29.33 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.183 -0.948 . . . . 0.0 110.037 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -66.53 -38.16 86.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.152 -0.968 . . . . 0.0 109.663 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -67.42 -24.19 65.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.23 -0.919 . . . . 0.0 109.617 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 20.4 t -86.79 30.27 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.224 -0.922 . . . . 0.0 109.667 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.475 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 2.7 p -95.17 126.5 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.138 -0.977 . . . . 0.0 109.765 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.455 ' C ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -151.7 22.84 0.69 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.323 -0.861 . . . . 0.0 109.943 -179.848 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.731 ' H ' ' HH ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -148.46 39.92 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.997 -1.064 . . . . 0.0 110.026 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.539 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -149.15 -165.71 2.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.925 -1.11 . . . . 0.0 110.596 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.426 ' N ' ' CG ' ' A' ' 108' ' ' PHE . . . -118.14 -50.55 2.46 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.747 -0.595 . . . . 0.0 109.773 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.62 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -158.7 157.1 31.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.101 -0.999 . . . . 0.0 109.952 -179.722 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.588 ' OE1' ' N ' ' A' ' 112' ' ' PHE . 0.0 OUTLIER -104.87 159.79 15.52 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.465 -0.772 . . . . 0.0 108.968 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.588 ' N ' ' OE1' ' A' ' 111' ' ' GLU . 23.6 m-85 -136.15 161.72 34.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.183 -0.948 . . . . 0.0 109.772 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 80.6 t -121.36 150.38 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.488 ' CG2' ' N ' ' A' ' 115' ' ' SER . 56.3 mt -138.65 161.06 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 110.182 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.488 ' N ' ' CG2' ' A' ' 114' ' ' ILE . 0.3 OUTLIER -141.18 6.3 1.94 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.347 -0.845 . . . . 0.0 109.311 179.449 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -150.95 155.41 39.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.035 -1.04 . . . . 0.0 109.924 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -70.53 -31.96 69.24 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.262 -0.899 . . . . 0.0 109.599 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -67.77 -16.67 64.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.152 -0.967 . . . . 0.0 108.99 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.594 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.0 OUTLIER -86.54 1.64 50.9 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.339 -0.851 . . . . 0.0 109.763 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.492 ' O ' ' OH ' ' A' ' 45' ' ' TYR . 6.5 mt -97.49 20.17 12.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.199 -0.938 . . . . 0.0 108.87 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -74.84 152.72 38.92 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.552 -0.718 . . . . 0.0 109.883 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.98 -48.65 57.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 109.844 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -12.32 7.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.063 -1.023 . . . . 0.0 109.744 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.594 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 9.4 t80 -86.58 -49.07 7.81 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.938 0.875 . . . . 0.0 109.371 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 3.4 mt -74.8 -26.35 19.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.729 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.583 ' CD ' ' HZ2' ' A' ' 130' ' ' LYS . 29.9 ttt180 -68.59 -54.57 15.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.9 t -63.77 -15.8 59.57 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.345 -0.847 . . . . 0.0 109.663 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.545 ' CD ' ' CD1' ' A' ' 112' ' ' PHE . 2.2 tt0 -76.6 -39.99 50.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 109.246 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 12.8 mt -73.34 -48.06 37.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.229 -0.919 . . . . 0.0 109.244 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.583 ' HZ2' ' CD ' ' A' ' 126' ' ' ARG . 13.7 mttt . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.116 -0.99 . . . . 0.0 109.376 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.551 ' OG1' ' NZ ' ' A' ' 93' ' ' LYS . 2.7 m . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -135.26 118.32 16.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.353 -0.842 . . . . 0.0 109.403 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -107.76 141.23 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.398 -0.814 . . . . 0.0 109.733 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -100.69 70.11 1.41 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.528 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.691 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -58.98 -24.49 62.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.243 -0.911 . . . . 0.0 109.494 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -46.06 68.14 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.449 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -67.47 0.44 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.549 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.82 -63.0 1.01 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.935 . . . . 0.0 109.845 -179.665 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 10.5 ttp180 -44.59 -56.26 4.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.909 -1.12 . . . . 0.0 109.678 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.44 -54.8 27.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.188 -0.945 . . . . 0.0 109.908 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.65 -43.72 83.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.134 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.54 ' CZ ' ' CB ' ' A' ' 61' ' ' PHE . 3.2 m-85 -46.8 -55.24 8.24 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.336 -0.852 . . . . 0.0 110.312 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.698 HD21 ' ND2' ' A' ' 107' ' ' ASN . 0.4 OUTLIER -78.94 -28.42 43.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.243 -0.911 . . . . 0.0 110.697 -178.703 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.7 tp -56.49 -19.29 14.68 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.792 -1.192 . . . . 0.0 109.473 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 1.5 m -77.58 -2.84 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.226 -0.921 . . . . 0.0 109.415 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.1 mtm180 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 -179.991 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.444 0.64 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.429 ' O ' ' CG2' ' A' ' 24' ' ' VAL . 13.9 m -78.4 122.88 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.437 -0.789 . . . . 0.0 109.649 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.454 HG23 ' N ' ' A' ' 26' ' ' TRP . 14.0 tt -49.96 -34.27 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 120.894 -1.129 . . . . 0.0 108.4 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.568 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 37.0 p-90 -160.95 171.57 18.46 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.259 -0.9 . . . . 0.0 109.402 177.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.7 m -137.0 143.59 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.249 -0.907 . . . . 0.0 109.287 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.0 p -132.47 134.71 45.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.293 -0.879 . . . . 0.0 109.701 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.421 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -123.61 153.97 39.95 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.944 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.71 150.18 52.24 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.521 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.589 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 1.8 m-85 -55.04 99.28 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.569 -0.707 . . . . 0.0 110.443 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.87 101.08 13.16 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 65.49 -117.32 9.89 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.8 25.64 11.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -1.112 . . . . 0.0 110.113 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -145.42 150.16 36.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.73 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mt -104.15 108.44 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.334 -0.854 . . . . 0.0 108.989 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.9 m -135.49 158.76 73.74 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.254 -0.904 . . . . 0.0 109.724 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 87.6 Cg_exo -30.08 142.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 123.493 2.795 . . . . 0.0 112.689 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -140.55 -30.67 0.17 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.462 ' OD1' ' OE1' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -142.5 -178.9 5.99 Favored 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.625 -0.926 . . . . 0.0 109.263 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.77 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -162.69 175.68 11.1 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.871 -178.678 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.14 137.26 4.65 Favored Glycine 0 N--CA 1.486 1.977 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.78 -3.42 20.45 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.0 177.54 10.25 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.37 -10.58 59.54 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 120.883 -1.135 . . . . 0.0 109.218 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.491 ' N ' HE21 ' A' ' 46' ' ' GLN . 7.3 mm-40 -74.99 -36.68 61.99 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.049 -1.032 . . . . 0.0 110.255 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.546 ' O ' ' N ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -62.89 -53.3 56.32 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.966 -1.084 . . . . 0.0 109.569 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.572 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -45.45 -28.02 0.82 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.188 -0.945 . . . . 0.0 108.72 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.428 HG12 ' CE2' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -83.93 -17.01 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.272 -0.892 . . . . 0.0 110.134 179.405 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' A' ' 47' ' ' HIS . 5.3 tt0 -81.73 -54.45 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.775 -1.203 . . . . 0.0 109.176 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.593 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -72.47 -12.13 60.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.795 . . . . 0.0 109.736 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.411 ' C ' ' O ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -42.94 126.28 3.78 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.279 -0.888 . . . . 0.0 109.637 -179.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.571 ' C ' ' H ' ' A' ' 55' ' ' ASP . 5.6 p -150.62 110.49 4.08 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.873 0.844 . . . . 0.0 110.608 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -57.38 0.35 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.786 -0.571 . . . . 0.0 110.039 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.571 ' H ' ' C ' ' A' ' 53' ' ' THR . 50.7 t0 -109.05 31.86 5.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 109.56 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.37 168.31 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.022 -1.049 . . . . 0.0 110.477 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.632 HH12 ' N ' ' A' ' 91' ' ' ARG . 5.4 ptp180 -141.95 134.91 28.81 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.274 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.506 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 4.1 pp -172.71 168.94 5.08 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.334 -0.854 . . . . 0.0 109.621 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -108.71 160.56 15.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.128 -0.982 . . . . 0.0 109.003 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.47 157.37 45.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.93 -1.106 . . . . 0.0 109.365 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.54 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 37.1 t80 -148.48 104.2 3.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.278 -0.889 . . . . 0.0 109.221 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -120.07 153.38 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.356 -0.84 . . . . 0.0 109.447 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.495 ' NE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ttp180 -88.36 108.58 19.42 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.476 -0.765 . . . . 0.0 109.049 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -89.24 155.69 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.339 -0.85 . . . . 0.0 109.794 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.9 t -86.16 128.35 34.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.259 -0.901 . . . . 0.0 108.882 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.556 -179.903 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.495 ' CB ' ' NE ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.7 tptt -104.83 154.81 19.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.564 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -127.58 122.28 32.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.434 -0.791 . . . . 0.0 109.651 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.62 167.27 22.94 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.64 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.966 ' O ' HD12 ' A' ' 79' ' ' ILE . 5.5 tt -122.6 157.98 30.96 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.966 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.3 mp -136.09 149.62 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.96 -1.088 . . . . 0.0 108.626 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.498 ' CG2' ' HZ2' ' A' ' 98' ' ' LYS . 55.7 m -112.66 120.09 40.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.515 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -95.18 111.87 23.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.124 -0.985 . . . . 0.0 109.853 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.0 mm -108.9 93.2 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 108.673 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.32 153.76 35.05 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -104.03 43.24 1.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.481 -1.011 . . . . 0.0 109.713 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.87 11.82 0.49 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.128 -0.982 . . . . 0.0 109.743 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.9 t -89.16 160.19 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.122 -0.986 . . . . 0.0 109.668 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -176.96 0.81 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.433 -0.792 . . . . 0.0 109.796 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.21 -16.53 66.79 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.83 -70.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.167 -1.196 . . . . 0.0 110.239 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.589 ' CB ' HH11 ' A' ' 57' ' ' ARG . 76.9 mm-40 -60.04 -18.83 49.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.197 -0.94 . . . . 0.0 110.181 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.637 HH11 ' CG ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -55.25 -58.36 8.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.797 -1.189 . . . . 0.0 109.604 -179.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.89 -25.2 32.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.203 -0.936 . . . . 0.0 109.747 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.551 ' NZ ' ' OG1' ' A' ' 3' ' ' THR . 0.1 OUTLIER -72.11 -27.13 62.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 109.075 179.64 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.589 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 2.2 m -76.81 -52.1 10.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.396 -0.815 . . . . 0.0 109.106 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.451 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -41.77 -51.86 4.79 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.62 -56.53 9.04 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -1.15 . . . . 0.0 110.125 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -44.82 -37.95 4.19 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.13 -0.982 . . . . 0.0 110.52 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.498 ' HZ2' ' CG2' ' A' ' 80' ' ' THR . 0.2 OUTLIER -59.39 -43.36 92.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.775 -1.203 . . . . 0.0 108.193 179.357 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.4 m -46.83 -35.03 5.86 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.108 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.5 mt -71.18 -57.66 4.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.621 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 p -67.9 -13.68 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.169 -0.957 . . . . 0.0 110.052 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -81.85 -42.51 19.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.0 110.363 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.66 -25.41 30.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.035 -1.041 . . . . 0.0 110.952 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.432 ' O ' ' C ' ' A' ' 105' ' ' VAL . 3.2 p -81.03 -34.09 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 120.805 -1.185 . . . . 0.0 110.169 -179.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.432 ' C ' ' O ' ' A' ' 104' ' ' VAL . 7.5 p -42.99 134.09 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.031 -1.043 . . . . 0.0 109.621 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.492 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 4.9 pt20 -141.03 26.6 2.02 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.698 ' ND2' HD21 ' A' ' 15' ' ' ASN . 96.3 m-20 -144.51 39.72 1.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.498 -0.751 . . . . 0.0 109.603 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -142.0 149.09 39.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.0 . . . . 0.0 109.766 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -87.19 -33.5 19.34 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.643 ' NZ ' ' CZ ' ' A' ' 112' ' ' PHE . 0.7 OUTLIER -162.32 155.66 20.49 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.279 -0.888 . . . . 0.0 109.353 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 102' ' ' LYS . 6.8 pt-20 -104.45 156.36 18.0 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.319 -0.863 . . . . 0.0 109.171 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.643 ' CZ ' ' NZ ' ' A' ' 110' ' ' LYS . 24.1 m-85 -139.67 157.39 45.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.207 -0.933 . . . . 0.0 109.895 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -119.99 109.22 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.559 -0.713 . . . . 0.0 109.305 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 35.3 mm -98.73 152.02 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.444 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.8 t -139.39 7.23 2.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.265 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.0 155.26 45.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.511 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -70.21 -34.92 73.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.969 . . . . 0.0 109.613 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.673 ' HE2' ' OE2' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -75.28 -16.29 60.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 0.0 109.103 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.58 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.7 mp0 -86.4 -4.85 59.24 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.35 -0.844 . . . . 0.0 109.513 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.65 8.74 44.12 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.255 -0.903 . . . . 0.0 108.965 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.673 ' OE2' ' HE2' ' A' ' 118' ' ' LYS . 63.7 mt-10 -63.68 139.05 58.73 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 0.0 109.505 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.744 ' OE1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -52.23 -50.62 61.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . 0.744 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.4 OUTLIER -59.05 -42.47 90.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.895 -1.128 . . . . 0.0 109.687 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.58 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 63.7 t80 -55.48 -44.73 76.78 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.009 0.909 . . . . 0.0 109.064 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -74.47 -25.23 19.21 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -67.49 -52.64 36.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.242 -0.911 . . . . 0.0 109.188 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -20.11 65.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.242 -0.911 . . . . 0.0 109.234 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -71.65 -42.54 67.41 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.307 -0.871 . . . . 0.0 109.271 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.7 mt -73.88 -51.64 15.55 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 109.042 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.3 mttm . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.209 -0.932 . . . . 0.0 109.287 179.885 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.2 m . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.4 mttp -123.67 129.06 50.54 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 109.532 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.8 tp -107.66 125.37 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.478 -0.764 . . . . 0.0 109.315 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.4 m-20 -97.61 43.39 1.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.208 -0.932 . . . . 0.0 109.293 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -42.32 -18.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 109.53 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 6' ' ' ASP . 34.4 mt-10 -55.89 -49.41 73.5 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 108.981 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -61.64 -66.58 0.51 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.353 -0.842 . . . . 0.0 108.939 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.6 m -44.83 -59.08 2.71 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.286 -0.884 . . . . 0.0 109.17 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.411 ' O ' ' C ' ' A' ' 12' ' ' ALA . 39.0 ttp180 -44.29 -56.06 4.45 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.034 -1.041 . . . . 0.0 109.744 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.74 -50.94 5.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.349 -0.845 . . . . 0.0 109.818 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' CG2' ' A' ' 17' ' ' VAL . . . -82.93 -35.07 26.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.377 -0.827 . . . . 0.0 110.262 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.704 ' CZ ' ' CE1' ' A' ' 61' ' ' PHE . 3.1 t80 -45.55 -65.79 0.49 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.367 -0.833 . . . . 0.0 110.302 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.69 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 3.5 m-80 -70.7 -44.55 66.71 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.326 -0.859 . . . . 0.0 110.756 -178.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.653 ' C ' ' H ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -51.75 -40.82 60.94 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.928 -1.107 . . . . 0.0 109.396 -179.158 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.441 ' CG2' ' O ' ' A' ' 13' ' ' ALA . 98.3 t -51.31 -2.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 120.934 -1.103 . . . . 0.0 109.735 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.653 ' H ' ' C ' ' A' ' 16' ' ' LEU . 1.6 ttp180 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.114 -0.991 . . . . 0.0 109.127 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.94 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.497 ' O ' ' CG1' ' A' ' 24' ' ' VAL . 13.0 p -85.53 109.97 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.453 HG23 ' N ' ' A' ' 26' ' ' TRP . 14.0 tt -56.86 -32.89 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.121 -0.987 . . . . 0.0 108.822 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.617 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 32.0 p-90 -160.7 149.67 16.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.229 -0.919 . . . . 0.0 109.876 178.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.1 m -117.55 134.73 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.487 -0.758 . . . . 0.0 109.263 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.404 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 40.8 p -124.9 143.63 50.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.362 -0.836 . . . . 0.0 109.901 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.654 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -121.74 163.6 18.81 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -140.89 146.67 37.77 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.359 -0.838 . . . . 0.0 109.835 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.588 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 3.3 m-85 -58.99 98.71 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.417 -0.802 . . . . 0.0 110.092 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.488 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.1 OUTLIER -100.02 101.19 12.2 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.424 ' O ' ' NZ ' ' A' ' 93' ' ' LYS . . . 73.08 -122.18 7.96 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.13 22.72 15.51 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.352 -1.087 . . . . 0.0 110.352 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.488 ' O ' ' OD1' ' A' ' 32' ' ' ASP . 4.0 m -138.39 153.88 48.92 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.081 -1.012 . . . . 0.0 110.197 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 1.7 mp -109.79 103.77 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.411 -0.806 . . . . 0.0 109.139 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.2 m -135.83 154.95 78.21 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.164 -0.96 . . . . 0.0 109.771 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.401 ' C ' ' O ' ' A' ' 37' ' ' VAL . 88.1 Cg_exo -32.27 140.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 123.231 2.621 . . . . 0.0 112.546 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -141.88 -21.51 0.25 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.551 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.18 -178.89 6.07 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.389 -1.065 . . . . 0.0 109.622 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.624 ' NE2' ' O ' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -157.74 179.81 8.86 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.627 0.727 . . . . 0.0 110.761 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.413 ' HA3' ' CE2' ' A' ' 26' ' ' TRP . . . -163.49 133.64 3.12 Favored Glycine 0 N--CA 1.485 1.951 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.456 ' O ' ' OD1' ' A' ' 44' ' ' ASP . . . -106.5 -8.56 17.01 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' A' ' 43' ' ' ALA . 59.5 m-20 -157.57 175.38 14.01 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.09 -41.37 67.39 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.806 -1.184 . . . . 0.0 109.267 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -51.58 -32.81 29.92 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.115 -0.991 . . . . 0.0 110.288 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.579 ' CE1' HE22 ' A' ' 41' ' ' GLN . 0.7 OUTLIER -65.37 -15.42 62.55 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.93 -1.106 . . . . 0.0 109.955 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -82.09 -27.65 32.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.941 -1.099 . . . . 0.0 108.774 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.411 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.9 mt -79.97 -19.36 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.251 -0.906 . . . . 0.0 110.91 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.546 ' NE2' ' C ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -87.02 -45.92 10.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.391 -1.443 . . . . 0.0 109.967 -179.684 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.601 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -105.32 56.66 0.68 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.261 -0.899 . . . . 0.0 110.884 -178.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 t -158.5 65.73 0.44 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.023 . . . . 0.0 109.501 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.586 ' C ' ' H ' ' A' ' 55' ' ' ASP . 20.6 p -85.19 150.62 24.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -0.924 . . . . 0.0 109.915 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.495 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 2.5 p30 -51.58 -4.05 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.453 -0.779 . . . . 0.0 109.99 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.586 ' H ' ' C ' ' A' ' 53' ' ' THR . 1.1 t0 -94.64 20.71 8.19 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.03 -1.044 . . . . 0.0 109.307 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.426 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -138.72 151.2 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 0.0 109.654 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.639 ' H ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -130.98 131.54 44.45 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.485 -0.76 . . . . 0.0 109.801 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.506 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 4.1 pp -172.66 175.52 3.43 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.995 -1.066 . . . . 0.0 110.504 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -111.24 152.68 26.87 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.57 156.99 45.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.956 -1.09 . . . . 0.0 109.628 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.704 ' CE1' ' CZ ' ' A' ' 14' ' ' TYR . 64.5 t80 -149.46 97.02 2.58 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.217 -0.927 . . . . 0.0 109.361 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.01 156.53 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.307 -0.871 . . . . 0.0 109.467 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -79.66 113.06 17.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.427 -0.796 . . . . 0.0 109.01 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -92.59 154.65 18.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.256 -0.902 . . . . 0.0 109.72 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.2 t -78.26 163.4 25.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 108.975 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.405 ' HA ' ' HZ3' ' A' ' 130' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.258 -0.901 . . . . 0.0 109.518 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.416 -0.586 . . . . 0.0 109.416 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.409 ' HG3' ' H ' ' A' ' 76' ' ' PHE . 6.9 ttmt -107.91 165.34 11.53 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.327 -0.858 . . . . 0.0 109.313 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.69 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 2.0 m-85 -133.25 128.65 36.32 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 109.813 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.78 167.06 23.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.341 -0.849 . . . . 0.0 110.581 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tt -117.41 157.65 25.84 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -135.16 148.27 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.03 -1.044 . . . . 0.0 109.248 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -108.06 113.95 27.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.356 -0.84 . . . . 0.0 109.827 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.426 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 66.6 t-105 -94.66 111.17 22.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.018 -1.051 . . . . 0.0 109.604 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.8 mm -112.24 92.99 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -53.29 149.29 12.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -94.35 35.24 1.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.32 -1.106 . . . . 0.0 109.554 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.534 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -153.29 25.97 0.53 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 87' ' ' SER . 4.0 p -98.11 159.63 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.15 -0.968 . . . . 0.0 109.725 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.416 ' H ' HG22 ' A' ' 86' ' ' VAL . 7.4 p -71.9 -176.24 1.64 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.0 110.01 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.19 -18.19 63.28 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -46.4 -57.2 4.87 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.083 -1.245 . . . . 0.0 109.618 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 49.0 mm-40 -57.51 -30.97 65.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.208 -0.933 . . . . 0.0 109.23 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 6.6 tpt180 -45.33 -56.42 4.94 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.053 -1.03 . . . . 0.0 109.425 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.82 -35.2 38.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.823 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 10.2 mttt -69.66 -61.64 1.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.128 -0.982 . . . . 0.0 109.875 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.588 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 28.4 m -45.02 -49.83 11.11 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.0 109.65 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -51.66 -59.43 8.55 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.501 ' HG1' ' H ' ' A' ' 97' ' ' ASP . 74.1 p -65.01 -48.29 74.44 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.014 -1.286 . . . . 0.0 111.173 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -69.08 -41.1 77.97 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.82 -1.175 . . . . 0.0 111.617 -177.535 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.404 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -61.23 -22.18 64.55 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.768 -1.208 . . . . 0.0 109.459 -179.416 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 20.4 m -73.92 -44.85 53.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.227 -0.92 . . . . 0.0 109.426 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.13 -54.73 43.63 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.204 -0.935 . . . . 0.0 109.586 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -28.05 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.164 -0.96 . . . . 0.0 109.914 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.72 -37.93 73.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.14 -0.975 . . . . 0.0 109.784 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -22.39 60.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.158 -0.964 . . . . 0.0 109.732 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.518 ' CG1' ' O ' ' A' ' 104' ' ' VAL . 88.6 t -94.26 33.82 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.55 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.1 t -131.75 98.93 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.298 -0.876 . . . . 0.0 109.873 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.595 ' O ' ' N ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -119.1 -41.4 2.75 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.69 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 33.2 p-10 -63.9 41.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 119.936 -0.705 . . . . 0.0 110.073 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.595 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -142.4 174.69 10.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.345 -0.847 . . . . 0.0 109.601 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.07 -56.76 3.19 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.205 -0.934 . . . . 0.0 109.5 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.548 ' HZ1' ' HE1' ' A' ' 112' ' ' PHE . 9.3 ttpp -162.37 167.17 24.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.294 -0.878 . . . . 0.0 109.33 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.514 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -104.37 154.06 20.3 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.192 -0.943 . . . . 0.0 108.968 179.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.548 ' HE1' ' HZ1' ' A' ' 110' ' ' LYS . 58.3 m-85 -128.61 156.2 43.74 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.444 -0.785 . . . . 0.0 110.166 -179.248 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 33.4 t -115.16 143.11 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 18.8 mm -136.08 154.07 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.078 -1.013 . . . . 0.0 110.439 -179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 64.4 m -140.59 3.6 1.9 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.611 -0.681 . . . . 0.0 109.218 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 1.164 ' OD1' ' CD ' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -143.12 155.29 44.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.189 -0.945 . . . . 0.0 109.526 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -73.96 -33.25 63.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 109.824 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.61 -8.76 54.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.199 -0.938 . . . . 0.0 109.007 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 1.164 ' CD ' ' OD1' ' A' ' 116' ' ' ASP . 21.7 mt-10 -86.35 -0.48 56.0 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -94.71 1.29 55.49 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.214 -0.929 . . . . 0.0 108.814 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.45 145.77 54.96 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.538 -0.726 . . . . 0.0 109.701 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -62.33 -49.24 76.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 0.0 109.581 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.15 -21.94 15.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.0 109.852 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 67.5 t80 -83.31 -49.21 9.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.301 -0.874 . . . . 0.0 109.148 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.5 mm -71.94 -25.2 23.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -65.09 -52.39 55.83 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.198 -0.939 . . . . 0.0 108.729 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.3 t -58.74 -24.5 61.71 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.323 -0.861 . . . . 0.0 109.197 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.84 -40.65 65.57 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.295 -0.878 . . . . 0.0 109.268 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 19.2 mt -73.64 -53.11 11.21 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.219 -0.925 . . . . 0.0 109.131 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 130' ' ' LYS . 11.3 mptt . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.143 -0.973 . . . . 0.0 109.601 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -137.32 118.21 14.22 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.275 -0.891 . . . . 0.0 109.364 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 tt -110.79 142.72 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.404 -0.81 . . . . 0.0 109.615 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 8' ' ' GLU . 4.5 m-20 -93.4 40.84 1.07 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.189 -0.944 . . . . 0.0 109.154 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.44 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -40.17 -22.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.712 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.57 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.3 tt0 -50.32 -34.05 22.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.186 -0.946 . . . . 0.0 109.232 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.8 -60.25 2.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.357 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.89 -62.82 1.08 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.209 -0.932 . . . . 0.0 109.682 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.654 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 38.7 ttp180 -45.17 -53.66 7.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.951 -1.093 . . . . 0.0 109.221 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -58.29 8.49 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.339 -0.85 . . . . 0.0 109.757 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.55 -25.57 62.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.535 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -70.76 -48.31 55.02 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.368 -0.832 . . . . 0.0 109.492 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.705 ' ND2' HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -79.58 -11.06 59.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.272 -0.893 . . . . 0.0 109.555 -179.994 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 tp -76.76 -29.01 55.93 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.265 -0.897 . . . . 0.0 109.212 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.43 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 0.8 OUTLIER -72.1 -1.57 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.298 -0.876 . . . . 0.0 109.194 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.512 ' CG ' ' O ' ' A' ' 18' ' ' ARG . 22.1 ttp180 . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.535 -0.728 . . . . 0.0 109.188 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.592 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.448 ' O ' ' C ' ' A' ' 25' ' ' ILE . 2.5 p -58.41 78.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.98 . . . . 0.0 108.94 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -41.02 -59.04 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 O-C-N 121.409 -0.807 . . . . 0.0 109.949 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.621 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 27.0 p-90 -134.02 156.49 48.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.826 -1.171 . . . . 0.0 110.834 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.5 p -134.27 135.77 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.7 p -124.28 146.22 48.91 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.097 -1.002 . . . . 0.0 110.541 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.92 136.9 54.19 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 32' ' ' ASP . 26.9 ptt180 -113.47 146.1 40.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.487 -0.758 . . . . 0.0 109.982 -178.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.681 ' CD2' ' NE2' ' A' ' 90' ' ' GLN . 1.9 m-85 -41.21 98.63 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.565 -0.709 . . . . 0.0 109.781 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -97.1 101.76 13.4 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 55.83 -119.35 13.74 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.83 22.46 15.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.453 -1.028 . . . . 0.0 110.098 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 43.8 m -145.31 134.06 22.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.123 -0.986 . . . . 0.0 109.909 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.3 mp -78.98 113.45 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.284 -0.885 . . . . 0.0 108.997 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.41 150.5 72.59 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.286 -0.884 . . . . 0.0 109.871 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -35.53 146.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.895 2.397 . . . . 0.0 112.303 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.99 -38.64 0.15 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.565 ' CG ' HE22 ' A' ' 51' ' ' GLN . 3.5 m-20 -142.62 -179.38 6.27 Favored 'General case' 0 C--N 1.296 -1.761 0 O-C-N 121.714 -0.874 . . . . 0.0 109.285 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.74 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -158.12 -169.39 2.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.354 -0.841 . . . . 0.0 109.685 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.15 143.96 7.75 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 119.521 -1.323 . . . . 0.0 110.163 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.04 0.29 29.65 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -152.29 170.71 19.37 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.425 ' O ' ' C ' ' A' ' 46' ' ' GLN . 17.8 p90 -79.63 -39.72 30.89 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.625 -1.297 . . . . 0.0 109.03 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 45' ' ' TYR . 6.0 mm-40 -42.42 -33.84 0.73 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.078 -1.014 . . . . 0.0 109.994 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.518 ' NE2' ' OE1' ' A' ' 50' ' ' GLN . 2.1 t-160 -61.74 -41.75 98.06 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.82 -1.175 . . . . 0.0 109.108 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.609 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -47.67 -33.22 6.56 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.63 -42.11 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.158 -0.964 . . . . 0.0 109.111 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.574 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 5.3 tm0? -86.96 -12.62 47.0 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.573 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 1.5 mm100 -109.97 67.25 0.64 Allowed 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.313 1.054 . . . . 0.0 110.472 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.573 ' SG ' ' O ' ' A' ' 51' ' ' GLN . 1.2 m 158.61 59.19 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.009 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.427 ' O ' ' NE1' ' A' ' 81' ' ' TRP . 1.4 p -77.41 164.02 25.86 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.966 -1.084 . . . . 0.0 109.707 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.3 OUTLIER -65.46 -4.52 5.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.632 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.29 14.46 31.89 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.282 -0.886 . . . . 0.0 109.504 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.5 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 2.5 p -138.18 157.14 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.236 -0.915 . . . . 0.0 109.745 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.522 ' N ' ' CD ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -134.76 129.03 34.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.554 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.498 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.7 pp -172.49 172.73 4.25 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 110.294 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -104.34 153.55 20.92 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.117 -0.99 . . . . 0.0 108.846 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -133.05 156.93 46.48 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.404 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 47.7 t80 -148.91 96.54 2.57 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -113.5 159.27 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.31 -0.868 . . . . 0.0 109.609 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.583 ' NE ' ' OG ' ' A' ' 74' ' ' SER . 1.1 ttt-85 -84.7 140.65 31.14 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.299 -0.875 . . . . 0.0 108.735 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -123.62 156.05 36.55 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.807 . . . . 0.0 110.221 -179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.6 t -77.22 135.11 38.46 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.476 -0.765 . . . . 0.0 109.5 -179.776 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.583 ' OG ' ' NE ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.93 155.38 19.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.84 . . . . 0.0 109.311 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.413 ' O ' ' N ' ' A' ' 109' ' ' ALA . 93.8 m-85 -134.02 120.25 20.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.394 -0.816 . . . . 0.0 109.746 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.74 167.2 22.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.604 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tt -121.18 155.42 34.59 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.2 mm -134.7 143.06 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.168 -0.957 . . . . 0.0 109.046 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.7 m -104.14 117.06 33.36 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 109.674 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.5 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -92.97 111.49 23.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.048 -1.033 . . . . 0.0 109.69 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -110.11 93.12 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.323 -0.861 . . . . 0.0 108.746 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.07 158.7 3.0 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -96.95 19.88 12.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.295 -1.121 . . . . 0.0 109.734 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -132.16 26.81 4.53 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.865 . . . . 0.0 109.215 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 t -91.21 160.98 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.357 -0.839 . . . . 0.0 110.094 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 t -93.37 -161.32 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.379 -0.825 . . . . 0.0 108.985 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -20.62 59.19 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.969 -1.253 . . . . 0.0 109.969 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.59 -64.65 0.71 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.987 -1.302 . . . . 0.0 110.023 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.681 ' NE2' ' CD2' ' A' ' 31' ' ' TYR . 10.8 mm100 -56.75 -30.22 63.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.8 tmm_? -49.6 -59.51 3.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.798 -1.188 . . . . 0.0 109.633 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.38 -39.88 27.58 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.174 -0.954 . . . . 0.0 109.796 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.447 ' C ' ' OH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -60.27 -65.3 0.71 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 109.515 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 51.1 m -45.16 -43.11 9.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.0 109.572 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.07 -60.45 3.5 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.8 m -66.05 -47.95 72.65 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.118 -1.225 . . . . 0.0 111.075 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -68.77 -42.86 76.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.78 -1.2 . . . . 0.0 111.386 -177.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -25.12 53.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.595 -1.316 . . . . 0.0 108.745 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 96.1 m -81.33 -20.7 40.14 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 53.2 mt -78.98 -63.79 1.33 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.44 -0.787 . . . . 0.0 109.185 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -50.3 -33.11 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.975 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.98 ' HE2' ' HG2' ' A' ' 111' ' ' GLU . 1.4 tttm -75.07 -42.37 57.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.269 -0.894 . . . . 0.0 109.751 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.31 -39.33 85.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.168 -0.957 . . . . 0.0 110.203 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.437 ' O ' ' C ' ' A' ' 105' ' ' VAL . 12.8 p -78.16 -25.68 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.07 -1.018 . . . . 0.0 109.926 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.437 ' C ' ' O ' ' A' ' 104' ' ' VAL . 1.0 OUTLIER -42.8 138.4 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.105 -0.997 . . . . 0.0 109.518 -179.927 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.47 ' NE2' ' CD ' ' A' ' 11' ' ' ARG . 11.6 pt20 -144.29 20.07 1.73 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.072 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.705 HD21 ' ND2' ' A' ' 15' ' ' ASN . 1.4 t-20 -143.18 41.16 1.5 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.896 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.566 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -142.52 158.0 44.14 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.032 . . . . 0.0 109.867 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.413 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -93.6 -34.34 13.35 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.354 -0.842 . . . . 0.0 109.446 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -162.27 159.54 25.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.871 . . . . 0.0 109.314 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.98 ' HG2' ' HE2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -104.2 150.69 24.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.199 -0.938 . . . . 0.0 109.337 -179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -133.84 157.62 45.46 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.451 -0.78 . . . . 0.0 109.701 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.6 t -121.19 142.47 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.427 ' CG2' ' N ' ' A' ' 115' ' ' SER . 1.8 mm -137.26 156.59 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.899 . . . . 0.0 110.058 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.482 ' O ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -140.64 9.19 2.2 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.607 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -158.79 157.05 30.88 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -79.74 -18.96 49.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.918 -1.114 . . . . 0.0 110.209 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -62.8 -50.06 72.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.087 -1.008 . . . . 0.0 110.428 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.607 ' OE2' ' N ' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -80.79 4.74 18.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 0.0 110.279 -179.098 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.429 ' N ' ' OE1' ' A' ' 119' ' ' GLU . 0.7 OUTLIER -96.38 16.62 17.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.007 -1.058 . . . . 0.0 108.405 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -74.63 154.6 38.45 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.66 -0.65 . . . . 0.0 109.78 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.41 -48.22 74.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.424 -0.798 . . . . 0.0 109.49 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 1.3 p30 -56.97 -41.59 78.62 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 109.658 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CG ' ' O ' ' A' ' 119' ' ' GLU . 15.4 t80 -60.36 -48.0 83.62 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.094 0.95 . . . . 0.0 109.093 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.4 mm -71.22 -40.15 74.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -62.14 -53.37 56.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.203 -0.935 . . . . 0.0 109.039 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -15.06 13.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.384 -0.822 . . . . 0.0 109.49 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.422 ' OE2' ' CZ ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -83.52 -37.24 23.32 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.21 -0.931 . . . . 0.0 109.358 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 46.8 mt -69.08 -39.72 78.88 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.193 -0.942 . . . . 0.0 108.631 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.303 -1.429 0 O-C-N 121.137 -0.977 . . . . 0.0 108.645 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.26 125.1 21.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.185 -0.947 . . . . 0.0 109.44 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.3 137.25 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.391 -0.818 . . . . 0.0 109.694 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.558 ' O ' ' N ' ' A' ' 8' ' ' GLU . 6.3 t70 -64.04 -44.61 91.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -0.89 . . . . 0.0 109.381 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt 63.89 -50.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.445 -0.785 . . . . 0.0 110.184 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 6' ' ' ASP . 10.9 mt-10 -51.8 -49.29 63.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.111 -0.993 . . . . 0.0 109.809 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.69 -69.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 109.999 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.651 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 4.1 m -46.08 -65.34 0.56 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.22 -0.925 . . . . 0.0 110.125 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.515 ' CZ ' ' CB ' ' A' ' 11' ' ' ARG . 0.9 OUTLIER -44.78 -58.39 3.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.985 -1.072 . . . . 0.0 110.144 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.95 -45.28 78.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.131 -0.981 . . . . 0.0 110.049 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.88 -17.02 59.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.058 -1.026 . . . . 0.0 110.183 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-30 -74.27 -52.96 10.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.125 -0.984 . . . . 0.0 109.539 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.671 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 1.8 m-80 -71.93 -13.32 61.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 109.42 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.8 tp -70.87 -47.99 56.23 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.356 -0.84 . . . . 0.0 109.575 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.7 m -64.97 -14.0 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.218 -0.926 . . . . 0.0 109.563 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.573 ' NH2' ' OD1' ' A' ' 15' ' ' ASN . 20.1 ttm180 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.267 -0.896 . . . . 0.0 109.508 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.543 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.543 ' C ' ' O ' ' A' ' 23' ' ' ALA . 9.1 m 21.5 69.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-O 120.821 0.343 . . . . 0.0 111.378 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 24' ' ' VAL . 13.0 tt -46.77 -31.06 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 120.743 -1.223 . . . . 0.0 108.08 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.624 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 22.8 p-90 -157.16 147.63 21.22 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.295 -0.878 . . . . 0.0 109.372 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.84 135.09 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.334 -0.854 . . . . 0.0 110.091 -179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.405 HG21 ' CZ3' ' A' ' 26' ' ' TRP . 47.5 p -131.18 133.88 45.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.48 -0.762 . . . . 0.0 109.73 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.651 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.44 167.28 14.06 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -140.89 143.75 34.84 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 119.231 -0.987 . . . . 0.0 109.813 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.483 ' OH ' ' OG1' ' A' ' 94' ' ' THR . 5.6 m-85 -50.37 98.68 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.544 -0.723 . . . . 0.0 109.744 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.66 101.35 13.04 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.08 -122.71 13.39 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.89 22.31 16.09 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.46 -1.023 . . . . 0.0 110.227 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 35.4 m -146.6 136.0 22.86 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.066 -1.021 . . . . 0.0 109.694 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mp -77.56 115.8 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.108 -0.995 . . . . 0.0 108.768 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -135.31 154.13 78.47 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.244 -0.91 . . . . 0.0 109.822 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -39.67 141.59 0.55 Allowed 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.752 2.301 . . . . 0.0 112.388 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.28 -40.8 0.17 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.597 ' CG ' ' H ' ' A' ' 41' ' ' GLN . 14.8 t70 -144.19 179.65 7.09 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.75 -0.853 . . . . 0.0 108.83 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.82 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -140.81 177.11 8.26 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.406 -0.808 . . . . 0.0 110.546 -179.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . -112.19 85.14 0.38 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.592 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -113.77 43.74 1.75 Allowed 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER 143.41 125.55 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.911 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -54.65 -53.86 49.23 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 0.0 109.551 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.462 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 5.1 mp0 -48.54 -20.22 0.41 Allowed 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.2 -0.938 . . . . 0.0 109.79 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.584 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -71.77 -34.01 69.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.195 -0.94 . . . . 0.0 109.225 179.655 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.592 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -56.03 -40.12 73.0 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.433 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.523 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.3 mt -58.74 -55.08 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.902 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -73.27 7.15 2.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.013 -1.055 . . . . 0.0 108.361 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.543 ' NE2' ' CG ' ' A' ' 40' ' ' ASP . 9.1 mm100 -116.07 -75.73 0.58 Allowed 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.17 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.552 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 2.5 m -65.82 48.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.125 -0.984 . . . . 0.0 109.496 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.534 ' N ' ' O ' ' A' ' 51' ' ' GLN . 0.7 OUTLIER -73.75 172.5 11.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.181 -0.949 . . . . 0.0 109.739 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.58 ' OD1' ' N ' ' A' ' 55' ' ' ASP . 1.1 p30 -55.27 -48.27 74.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.273 -0.892 . . . . 0.0 109.763 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.58 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.5 OUTLIER -76.28 42.21 0.26 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 -179.874 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.561 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 96.0 t -148.19 147.18 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 109.836 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -138.38 120.91 16.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.404 -0.81 . . . . 0.0 109.516 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.495 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.5 pp -172.86 175.97 3.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.076 -1.015 . . . . 0.0 110.462 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.424 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 3.9 m-85 -104.46 152.03 22.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.984 -1.072 . . . . 0.0 108.807 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -133.43 152.04 51.87 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.965 -1.085 . . . . 0.0 109.017 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.461 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 39.5 t80 -150.82 96.93 2.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.076 . . . . 0.0 109.498 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.55 154.89 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.248 -0.907 . . . . 0.0 108.949 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -80.7 113.29 18.79 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.359 -0.838 . . . . 0.0 108.983 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.561 ' CE2' ' HB2' ' A' ' 77' ' ' ALA . 12.5 m-85 -93.87 155.8 16.99 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.88 . . . . 0.0 109.661 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.97 149.62 34.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.164 -0.96 . . . . 0.0 108.97 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.435 ' HG1' ' CD ' ' A' ' 75' ' ' LYS . 90.5 m . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.438 -0.789 . . . . 0.0 109.473 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 64' ' ' PHE . 0.6 OUTLIER -104.74 157.69 17.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.393 -0.817 . . . . 0.0 109.89 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -133.26 119.73 20.18 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.458 -0.776 . . . . 0.0 109.054 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.561 ' HB2' ' CE2' ' A' ' 64' ' ' PHE . . . -144.09 156.8 44.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.091 -1.006 . . . . 0.0 110.947 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.6 tt -106.57 157.29 17.79 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.455 ' CG2' ' CG1' ' A' ' 114' ' ' ILE . 36.9 mt -137.36 133.26 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 120.92 -1.113 . . . . 0.0 109.066 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.3 m -95.72 117.76 31.12 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.165 -0.959 . . . . 0.0 109.653 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.561 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -93.02 110.38 21.85 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.089 -1.007 . . . . 0.0 109.729 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -105.21 93.01 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.09 156.35 19.76 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.565 ' C ' ' H ' ' A' ' 86' ' ' VAL . 2.9 mm-40 -78.72 -51.47 9.76 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -1.163 . . . . 0.0 109.63 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -67.0 39.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.183 -0.948 . . . . 0.0 109.57 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.565 ' H ' ' C ' ' A' ' 84' ' ' GLU . 92.8 t -96.63 157.3 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.23 -0.919 . . . . 0.0 109.725 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.2 p -99.38 -161.49 0.88 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.324 -0.86 . . . . 0.0 109.461 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.03 -15.97 68.54 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.8 mp -46.93 -54.27 10.44 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.073 -1.251 . . . . 0.0 109.408 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.685 ' NE2' ' N ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -57.29 -35.16 69.46 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.865 . . . . 0.0 109.165 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.685 ' N ' ' NE2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -47.6 -62.72 1.31 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.061 -1.024 . . . . 0.0 109.961 -179.358 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.09 -40.52 19.72 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.13 -0.981 . . . . 0.0 110.132 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.444 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 56.8 mmtt -61.66 -59.05 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 0.0 110.312 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.483 ' OG1' ' OH ' ' A' ' 31' ' ' TYR . 27.3 m -55.78 -49.09 74.1 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.962 -1.086 . . . . 0.0 109.516 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.474 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.87 -62.12 2.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.7 p -64.91 -49.26 71.11 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.118 -1.225 . . . . 0.0 111.104 -178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.563 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -66.85 -42.18 86.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.914 -1.116 . . . . 0.0 111.401 -177.824 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -22.64 63.55 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.623 -1.298 . . . . 0.0 109.201 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -82.3 -21.47 36.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.368 -0.833 . . . . 0.0 108.812 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.4 mt -83.46 -61.94 1.71 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.397 -0.815 . . . . 0.0 109.272 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.508 ' CG1' ' N ' ' A' ' 102' ' ' LYS . 8.6 p -46.78 -46.85 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.76 ' HD3' ' OE2' ' A' ' 111' ' ' GLU . 3.3 ttmt -66.31 -44.29 83.82 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.232 -0.918 . . . . 0.0 109.615 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' A' ' 105' ' ' VAL . 12.2 mt-10 -47.98 -68.53 0.18 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.221 -0.925 . . . . 0.0 110.153 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.414 ' O ' ' CG2' ' A' ' 104' ' ' VAL . 14.5 p -74.16 42.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -0.947 . . . . 0.0 110.05 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.426 ' H ' ' C ' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -121.0 167.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.417 -0.802 . . . . 0.0 109.712 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.621 ' C ' ' H ' ' A' ' 108' ' ' PHE . 3.1 pt20 -177.21 -29.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.671 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 1.3 m-20 -66.77 26.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.528 -0.732 . . . . 0.0 109.738 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.621 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -139.82 154.29 47.31 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.0 109.478 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.43 -31.98 14.4 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.476 -0.765 . . . . 0.0 109.778 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -162.35 152.37 16.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.76 ' OE2' ' HD3' ' A' ' 102' ' ' LYS . 7.8 pt-20 -104.87 156.9 17.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.894 . . . . 0.0 108.682 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -142.28 158.35 43.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.943 -1.098 . . . . 0.0 110.894 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.1 p -117.01 158.12 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.455 ' CG1' ' CG2' ' A' ' 79' ' ' ILE . 4.4 mm -138.07 154.5 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.083 -1.011 . . . . 0.0 110.314 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.63 -0.12 2.92 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.412 ' H ' HG21 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -155.08 155.35 33.92 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.381 -0.824 . . . . 0.0 109.072 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -74.39 -24.75 59.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.005 . . . . 0.0 109.912 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.528 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 1.0 OUTLIER -68.82 -14.52 63.08 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.135 -0.978 . . . . 0.0 109.144 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.585 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 10.2 mm-40 -87.09 4.1 43.51 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.767 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 9.2 mt -107.18 31.17 5.57 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.278 -0.889 . . . . 0.0 109.577 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 118' ' ' LYS . 1.6 mt-10 -79.27 138.08 37.63 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.044 -1.035 . . . . 0.0 109.903 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -46.0 -53.75 9.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.095 -1.003 . . . . 0.0 109.477 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . 0.733 ' OD1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -60.78 -38.6 85.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.277 -0.89 . . . . 0.0 109.735 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.585 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 20.8 t80 -61.06 -48.18 82.94 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.208 -0.932 . . . . 0.0 109.157 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.0 mm -58.96 -21.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.562 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -82.24 -44.97 15.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.129 -0.982 . . . . 0.0 109.838 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.7 t -58.33 -30.94 67.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.246 -0.909 . . . . 0.0 109.842 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -85.24 -38.93 18.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.582 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.2 -27.82 66.72 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.122 -0.986 . . . . 0.0 109.295 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.3 mttp . . . . . 0 N--CA 1.488 1.474 0 O-C-N 121.172 -0.955 . . . . 0.0 109.106 179.711 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.1 mttp -128.77 124.06 34.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.466 -0.771 . . . . 0.0 109.442 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.0 tp -107.59 130.32 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.379 -0.825 . . . . 0.0 109.476 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -102.86 60.89 0.79 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.148 -0.97 . . . . 0.0 109.451 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.669 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -45.52 -14.11 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.065 -1.022 . . . . 0.0 109.51 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 6' ' ' ASP . 4.0 mt-10 -55.53 -50.74 69.19 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.199 -0.938 . . . . 0.0 109.443 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.29 -58.19 6.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 109.383 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.588 ' SG ' ' CZ ' ' A' ' 29' ' ' PHE . 3.3 m -57.05 -65.17 0.66 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 109.776 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.586 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 9.7 tmm_? -44.62 -57.68 3.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.981 -1.075 . . . . 0.0 109.959 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.64 -33.05 53.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.169 -0.957 . . . . 0.0 109.366 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.2 -39.69 25.03 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.75 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.667 ' CZ ' ' CG ' ' A' ' 61' ' ' PHE . 1.5 m-85 -50.27 -49.23 53.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.23 -0.919 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.708 ' H ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -80.13 -17.42 52.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.099 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.1 tp -70.61 -22.72 62.51 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.414 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 4.5 m -92.0 -3.09 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.91 . . . . 0.0 109.529 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.639 HH11 ' CG ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.317 -0.865 . . . . 0.0 109.382 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.569 0.7 . . . . 0.0 110.405 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.515 ' O ' ' CG2' ' A' ' 24' ' ' VAL . 2.4 m -39.18 123.53 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.512 -0.742 . . . . 0.0 110.494 -179.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.441 HG21 ' H ' ' A' ' 26' ' ' TRP . 0.3 OUTLIER -63.09 -55.0 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.597 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 17.7 p-90 -128.86 165.13 21.61 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -133.48 133.52 57.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.24 -0.912 . . . . 0.0 109.278 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 72.5 p -125.87 137.83 53.76 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.283 -0.885 . . . . 0.0 109.65 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.657 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.65 163.56 16.27 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 178.475 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.661 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -141.0 142.22 34.27 Favored 'General case' 0 C--N 1.294 -1.831 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.538 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.607 ' HH ' ' N ' ' A' ' 94' ' ' THR . 6.6 m-85 -42.76 98.55 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.486 -0.759 . . . . 0.0 109.887 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 30' ' ' ARG . 1.3 t0 -97.97 101.59 13.12 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 57.68 -120.18 20.12 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.076 -1.61 . . . . 0.0 109.076 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.67 22.94 15.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -1.06 . . . . 0.0 110.292 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.8 m -143.47 134.95 26.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.107 -0.996 . . . . 0.0 110.014 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.54 ' CD1' ' OD2' ' A' ' 97' ' ' ASP . 1.6 mp -84.44 110.27 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.302 -0.874 . . . . 0.0 108.969 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 m -135.8 158.58 73.78 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.277 -0.889 . . . . 0.0 109.662 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -50.74 135.78 42.23 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.754 2.303 . . . . 0.0 111.585 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.422 ' HA3' HH11 ' A' ' 30' ' ' ARG . . . -130.4 -22.96 1.04 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.605 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.8 m-20 -142.68 -178.35 5.74 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.492 -1.005 . . . . 0.0 109.425 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.835 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -163.22 -176.99 5.1 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.435 -0.79 . . . . 0.0 109.764 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -157.27 141.92 8.23 Favored Glycine 0 N--CA 1.489 2.174 0 C-N-CA 119.549 -1.31 . . . . 0.0 109.9 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.3 -8.8 18.03 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -157.52 174.83 14.78 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.574 ' CZ ' ' CE2' ' A' ' 48' ' ' PHE . 31.0 t80 -73.68 -10.64 59.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.277 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.572 ' O ' ' CD1' ' A' ' 49' ' ' ILE . 46.0 mm-40 -75.61 -30.29 59.51 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.187 -0.946 . . . . 0.0 110.636 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.533 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -79.36 -4.0 48.87 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.609 -1.307 . . . . 0.0 110.044 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.574 ' CE2' ' CZ ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -83.13 -51.51 7.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.835 -1.166 . . . . 0.0 110.193 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.677 ' CD1' ' H ' ' A' ' 49' ' ' ILE . 0.1 OUTLIER -63.03 -32.66 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 120.876 -1.14 . . . . 0.0 109.137 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.93 -21.5 60.87 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.605 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.0 OUTLIER -96.46 -15.1 21.92 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.527 -179.187 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.565 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 7.5 m -117.92 52.44 1.0 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.414 -0.804 . . . . 0.0 110.228 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 55' ' ' ASP . 23.3 p -72.48 166.87 21.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.911 -1.118 . . . . 0.0 109.266 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -70.47 12.21 0.27 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 109.768 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.498 ' H ' ' C ' ' A' ' 53' ' ' THR . 5.9 m-20 -120.49 24.82 10.15 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.398 -0.814 . . . . 0.0 109.749 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.418 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 6.8 p -148.11 162.79 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.577 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.487 ' O ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -138.38 126.09 22.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.261 -0.899 . . . . 0.0 110.178 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.506 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.0 pp -172.85 173.81 3.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.165 -0.96 . . . . 0.0 110.0 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.53 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.6 OUTLIER -107.19 154.52 21.08 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.22 -0.925 . . . . 0.0 108.739 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.74 157.53 46.47 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.166 -0.959 . . . . 0.0 109.458 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.667 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 85.8 t80 -149.85 96.6 2.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.269 -0.895 . . . . 0.0 109.27 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.5 158.12 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.253 -0.904 . . . . 0.0 109.305 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -84.39 127.25 33.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.194 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -104.22 155.93 18.32 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 109.761 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.8 m -79.78 143.35 34.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.355 -0.841 . . . . 0.0 109.108 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.8 m . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.457 -0.777 . . . . 0.0 109.362 179.868 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.34 152.46 28.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.355 -0.84 . . . . 0.0 109.44 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.667 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 1.7 m-85 -134.17 126.46 29.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.411 -0.806 . . . . 0.0 109.683 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.64 159.32 43.0 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.794 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.8 tt -113.08 155.84 24.19 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.0 mt -138.06 135.68 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.915 -1.116 . . . . 0.0 109.121 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.3 m -95.93 120.24 35.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.565 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 64.9 t-105 -92.86 111.32 22.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.028 -1.045 . . . . 0.0 109.878 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -107.52 92.88 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.64 147.36 48.15 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.19 -14.1 60.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.31 -1.112 . . . . 0.0 109.582 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.59 37.02 1.41 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 109.492 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.79 160.47 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.0 m -91.64 -170.29 2.55 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.373 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -18.1 64.07 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 90' ' ' GLN . 8.0 mt -51.08 -69.79 0.1 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.15 -1.206 . . . . 0.0 109.5 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.552 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 0.9 OUTLIER -44.61 -33.94 1.98 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 109.292 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.417 ' HA ' ' HE ' ' A' ' 91' ' ' ARG . 1.1 tpm_? -45.62 -61.69 1.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.693 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.7 -37.24 42.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.193 -0.942 . . . . 0.0 109.487 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.584 ' C ' ' HH ' ' A' ' 31' ' ' TYR . 0.1 OUTLIER -64.75 -66.31 0.56 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.943 . . . . 0.0 109.834 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.607 ' N ' ' HH ' ' A' ' 31' ' ' TYR . 95.6 m -44.74 -40.68 6.22 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.25 -0.906 . . . . 0.0 109.562 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.489 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -51.12 -57.22 11.68 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 35.0 p -67.92 -47.99 67.2 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.957 -1.32 . . . . 0.0 110.909 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.54 ' OD2' ' CD1' ' A' ' 36' ' ' ILE . 9.6 t0 -69.66 -45.37 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.816 -1.177 . . . . 0.0 111.03 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.499 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -55.38 -24.26 28.87 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.774 -1.17 . . . . 0.0 108.604 -179.734 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.3 OUTLIER -67.23 -50.24 61.43 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.338 -0.851 . . . . 0.0 108.79 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.4 mp -51.33 -54.67 24.01 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.292 -0.88 . . . . 0.0 109.499 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.405 ' O ' ' C ' ' A' ' 102' ' ' LYS . 31.2 t -48.94 -74.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.148 -0.97 . . . . 0.0 109.945 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 101' ' ' VAL . 32.8 mtmt -43.13 -48.96 6.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.152 -0.968 . . . . 0.0 109.681 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 105' ' ' VAL . 46.6 mt-10 -57.58 -57.37 12.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.921 . . . . 0.0 110.045 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.504 ' CG1' ' O ' ' A' ' 104' ' ' VAL . 97.5 t -75.56 40.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 109.911 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' A' ' 103' ' ' GLU . 2.2 t -138.23 113.04 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.098 -1.001 . . . . 0.0 109.863 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.621 ' O ' ' N ' ' A' ' 108' ' ' PHE . 1.0 OUTLIER -124.2 -30.24 3.47 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 9.3 m-20 -61.21 35.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.822 -0.549 . . . . 0.0 110.214 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.621 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -149.71 -178.06 6.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.066 -1.021 . . . . 0.0 110.135 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.96 -62.76 1.29 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.414 -0.804 . . . . 0.0 109.925 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.534 ' NZ ' ' CB ' ' A' ' 110' ' ' LYS . 5.6 ttpm? -147.4 173.9 12.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.22 -0.925 . . . . 0.0 109.6 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.491 ' H ' ' CG ' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -104.62 155.43 18.85 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.932 . . . . 0.0 109.192 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -135.43 150.67 49.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.272 -0.893 . . . . 0.0 110.069 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.8 p -116.29 147.26 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.428 HG23 HD13 ' A' ' 114' ' ' ILE . 27.5 mm -138.5 156.56 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.188 -0.945 . . . . 0.0 110.375 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.403 ' O ' ' OG ' ' A' ' 115' ' ' SER . 0.3 OUTLIER -140.75 6.03 2.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 117' ' ' ARG . 43.3 t0 -150.14 155.36 39.67 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.866 . . . . 0.0 109.409 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.579 ' N ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -79.04 -28.39 43.23 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.197 -0.939 . . . . 0.0 110.047 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -73.99 -14.74 61.07 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.603 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -86.41 4.63 38.67 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -0.821 . . . . 0.0 109.744 -179.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.419 ' O ' ' OH ' ' A' ' 45' ' ' TYR . 7.2 mt -114.12 29.48 7.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.362 -0.837 . . . . 0.0 109.652 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 124' ' ' PHE . 4.0 mm-40 -76.83 141.83 40.51 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.351 -0.843 . . . . 0.0 109.287 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 121' ' ' GLU . 1.3 mt-10 -41.31 -52.4 3.46 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.187 -0.945 . . . . 0.0 109.742 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.2 -10.88 45.81 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.307 -0.87 . . . . 0.0 110.868 -179.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.603 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 18.0 t80 -86.34 -48.81 8.15 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.737 -1.227 . . . . 0.0 109.359 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -76.24 -20.56 15.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -73.34 -53.35 10.99 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.27 -0.894 . . . . 0.0 108.951 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.65 -18.66 65.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.315 -0.866 . . . . 0.0 109.315 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.404 ' CG ' ' O ' ' A' ' 124' ' ' PHE . 5.7 mm-40 -72.36 -43.09 64.53 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.191 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.1 mt -66.51 -36.39 82.59 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? . . . . . 0 C--N 1.303 -1.432 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.81 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.641 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.666 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.578 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.775 HD21 HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.541 ' O ' ' CG1' ' A' ' 17' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.448 ' C ' ' O ' ' A' ' 24' ' ' VAL . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.666 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.537 ' OH ' ' CG2' ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.429 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.544 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.464 ' CA ' ' CE2' ' A' ' 26' ' ' TRP . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.432 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.3 mm100 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 56' ' ' VAL . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.433 ' H ' ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.496 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.8 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.673 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.8 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.46 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.525 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.537 ' CG2' ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.409 ' OD2' ' CD1' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.439 ' CG2' ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.478 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.775 HD21 HD21 ' A' ' 15' ' ' ASN . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.59 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -139.61 118.44 12.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.236 -0.915 . . . . 0.0 109.47 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.3 tt -113.84 147.21 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.522 -0.736 . . . . 0.0 109.653 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -94.37 63.0 2.97 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.218 -0.926 . . . . 0.0 109.111 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.68 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.49 -26.16 60.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 109.55 -179.705 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.87 -46.6 71.36 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.278 -0.889 . . . . 0.0 109.407 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -60.86 -68.12 0.34 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.947 . . . . 0.0 109.582 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.76 -58.9 2.79 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.164 -0.96 . . . . 0.0 109.859 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 8.5 ttt180 -44.41 -59.57 2.35 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.925 -1.109 . . . . 0.0 110.219 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.75 -37.0 65.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.937 . . . . 0.0 110.038 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.6 -19.17 36.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.096 -1.003 . . . . 0.0 110.117 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.505 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -72.62 -53.89 10.62 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.111 -0.993 . . . . 0.0 109.569 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.7 ' ND2' HD21 ' A' ' 107' ' ' ASN . 1.7 m-80 -68.51 -25.68 65.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.221 -0.924 . . . . 0.0 109.547 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.64 -61.33 2.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.233 -0.917 . . . . 0.0 109.329 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.4 m -51.84 -19.41 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 109.733 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.169 -0.957 . . . . 0.0 109.507 -179.852 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.494 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.494 ' C ' ' O ' ' A' ' 23' ' ' ALA . 4.8 m 31.94 74.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.846 -0.534 . . . . 0.0 110.686 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.448 ' C ' ' O ' ' A' ' 24' ' ' VAL . 6.3 tt -44.49 -38.4 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.089 -1.007 . . . . 0.0 108.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.618 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 43.5 p-90 -150.57 162.51 40.5 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.397 -0.814 . . . . 0.0 109.25 178.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.8 m -133.26 139.4 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 109.187 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.7 p -128.98 139.93 51.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.34 -0.85 . . . . 0.0 110.179 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.18 133.36 51.58 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 16.9 ptt180 -108.59 147.41 31.85 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.852 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.545 ' HH ' ' CG ' ' A' ' 97' ' ' ASP . 14.5 m-85 -47.55 98.66 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.565 -0.709 . . . . 0.0 109.766 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -96.02 101.97 13.7 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.7 -120.23 21.47 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.99 22.25 16.23 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.326 -1.103 . . . . 0.0 110.228 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.0 m -145.33 136.99 25.35 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.581 ' CD1' ' N ' ' A' ' 36' ' ' ILE . 1.9 mp -81.62 114.35 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.221 -0.924 . . . . 0.0 108.979 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -135.46 152.0 75.7 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 109.717 -179.56 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 97.0 Cg_exo -33.12 145.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 122.971 2.447 . . . . 0.0 112.252 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -137.44 -36.45 0.17 Allowed Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.626 ' CG ' HE22 ' A' ' 51' ' ' GLN . 2.7 m-20 -142.67 -179.81 6.54 Favored 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.731 -0.864 . . . . 0.0 109.419 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.825 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -157.03 179.8 8.94 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.995 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.27 133.09 2.89 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.45 -3.04 24.52 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.82 175.97 12.92 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -42.42 70.55 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 120.677 -1.264 . . . . 0.0 108.946 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.489 ' NE2' ' N ' ' A' ' 46' ' ' GLN . 0.7 OUTLIER -43.09 -35.54 1.34 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.305 -0.872 . . . . 0.0 110.674 -179.328 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.536 ' CE1' ' OE1' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -62.95 -22.56 66.88 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.013 -1.054 . . . . 0.0 109.532 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.553 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -68.44 -23.97 64.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.202 -0.936 . . . . 0.0 108.718 179.489 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.551 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.4 mt -76.57 -54.02 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.582 -0.699 . . . . 0.0 109.927 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.455 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -65.56 -2.94 3.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 179.413 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.626 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.1 mm100 -106.13 -37.54 6.56 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.11 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.466 ' O ' ' CG2' ' A' ' 53' ' ' THR . 0.1 OUTLIER -49.32 132.43 20.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.287 -0.883 . . . . 0.0 109.644 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.574 ' C ' ' H ' ' A' ' 55' ' ' ASP . 20.6 p -160.07 115.29 2.34 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.4 -0.813 . . . . 0.0 110.555 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.74 11.36 0.1 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.628 -0.67 . . . . 0.0 109.587 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.574 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -122.71 16.68 10.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.495 -0.753 . . . . 0.0 109.324 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.532 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -135.72 154.26 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.4 -0.813 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.717 ' H ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.59 131.73 43.52 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.355 -0.841 . . . . 0.0 109.519 -179.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.502 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.8 pp -172.69 172.39 4.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.974 -1.078 . . . . 0.0 110.317 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.567 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 2.2 m-85 -106.01 153.96 21.29 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -135.83 156.9 48.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.02 -1.05 . . . . 0.0 109.556 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 53.9 t80 -148.19 97.57 2.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.358 -0.839 . . . . 0.0 109.21 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.503 ' O ' ' CE1' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -115.74 150.97 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -80.47 108.6 14.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.276 -0.89 . . . . 0.0 108.96 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CE1' ' O ' ' A' ' 62' ' ' VAL . 14.9 m-85 -86.72 155.76 20.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.324 -0.86 . . . . 0.0 109.805 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.55 161.04 28.19 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.298 -0.876 . . . . 0.0 108.848 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 0.0 109.466 -179.902 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.579 ' NZ ' ' O ' ' A' ' 129' ' ' LEU . 2.6 mmtp -104.59 154.98 19.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.846 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.582 ' O ' ' N ' ' A' ' 109' ' ' ALA . 84.3 m-85 -133.22 118.8 19.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.151 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.36 167.18 23.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.139 -0.976 . . . . 0.0 111.024 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.417 ' HG ' ' N ' ' A' ' 79' ' ' ILE . 9.2 tp -111.87 151.64 28.87 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.417 ' N ' ' HG ' ' A' ' 78' ' ' LEU . 22.1 mt -130.35 129.54 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.99 -1.069 . . . . 0.0 108.758 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.7 m -95.86 115.05 26.86 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.532 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 62.8 t-105 -92.97 111.23 22.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.101 -0.999 . . . . 0.0 109.651 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.9 mm -104.1 93.19 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 108.906 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.59 137.6 39.7 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -79.55 53.22 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.286 -1.126 . . . . 0.0 109.653 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -141.22 -30.99 0.6 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.17 -0.956 . . . . 0.0 109.81 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.433 ' CG2' ' NE2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -64.83 156.81 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.188 -0.945 . . . . 0.0 109.623 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.453 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 54.9 p -96.04 -127.89 0.14 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.363 -0.836 . . . . 0.0 109.587 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.453 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.17 -18.33 63.01 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.53 ' O ' ' CG ' ' A' ' 93' ' ' LYS . 3.4 mt -46.14 -48.9 17.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.971 -1.311 . . . . 0.0 109.934 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.433 ' NE2' ' CG2' ' A' ' 86' ' ' VAL . 3.1 pt20 -66.03 -26.39 67.49 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.145 -0.972 . . . . 0.0 109.908 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -56.39 -67.2 0.32 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.966 -1.084 . . . . 0.0 110.188 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.77 -44.43 49.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.18 -0.95 . . . . 0.0 110.131 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 89' ' ' LEU . 12.3 mmtm -55.82 -65.19 0.64 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.208 -0.933 . . . . 0.0 110.102 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 8.0 m -50.78 -49.68 57.75 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.131 -0.981 . . . . 0.0 109.679 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -46.94 -61.1 4.58 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 m -63.91 -51.12 65.94 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.031 -1.276 . . . . 0.0 111.78 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -74.57 -39.76 62.07 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.725 -1.234 . . . . 0.0 111.784 -177.183 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.588 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -55.36 -26.36 40.65 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 120.585 -1.322 . . . . 0.0 108.642 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.405 ' H ' ' HG1' ' A' ' 99' ' ' THR . 1.0 OUTLIER -78.45 -30.34 47.42 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.425 ' O ' ' C ' ' A' ' 101' ' ' VAL . 2.0 mt -71.18 -64.57 0.89 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.439 -0.788 . . . . 0.0 109.339 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.529 ' CG1' ' N ' ' A' ' 102' ' ' LYS . 9.9 p -41.9 -45.46 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.209 -0.932 . . . . 0.0 110.008 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.529 ' N ' ' CG1' ' A' ' 101' ' ' VAL . 6.1 ttpt -65.99 -39.4 90.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.271 -0.893 . . . . 0.0 109.597 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.416 ' C ' ' H ' ' A' ' 105' ' ' VAL . 1.8 mt-10 -60.66 -51.27 70.11 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.251 -0.906 . . . . 0.0 110.156 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 40.2 t -77.64 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.099 -1.001 . . . . 0.0 109.954 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.416 ' H ' ' C ' ' A' ' 103' ' ' GLU . 1.7 p -112.57 136.55 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.338 -0.851 . . . . 0.0 109.513 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -145.65 24.67 1.36 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.373 -0.829 . . . . 0.0 108.928 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.7 HD21 ' ND2' ' A' ' 15' ' ' ASN . 2.8 t-20 -135.39 -25.32 1.33 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.432 -0.792 . . . . 0.0 110.141 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -76.86 171.1 15.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.388 -179.561 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -117.79 -31.74 5.04 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.761 ' HE2' ' CE1' ' A' ' 112' ' ' PHE . 3.2 ttpm? -162.46 152.05 15.89 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.507 -0.746 . . . . 0.0 109.16 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -104.43 155.45 18.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.127 -0.983 . . . . 0.0 109.088 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.761 ' CE1' ' HE2' ' A' ' 110' ' ' LYS . 9.4 m-85 -133.88 156.44 48.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.366 -0.834 . . . . 0.0 109.819 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.531 ' CG1' ' O ' ' A' ' 113' ' ' VAL . 13.0 p -113.44 97.41 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 30.4 mm -100.32 142.44 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.228 -0.92 . . . . 0.0 109.888 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.1 m -141.1 15.6 2.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.308 -0.87 . . . . 0.0 109.548 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.9 155.34 46.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.034 -1.041 . . . . 0.0 110.124 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -69.71 -36.25 75.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 109.709 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -76.3 -17.36 59.48 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -83.25 -15.84 48.71 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.44 30.95 4.62 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.723 ' C ' ' CD ' ' A' ' 121' ' ' GLU . 0.0 OUTLIER -74.54 -175.31 2.35 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.448 0.642 . . . . 0.0 110.367 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.476 ' C ' ' OE2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -84.06 -44.65 13.88 Favored 'General case' 0 C--N 1.295 -1.771 0 O-C-N 121.36 -0.838 . . . . 0.0 110.145 177.272 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -85.79 -44.89 12.11 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 114.884 1.438 . . . . 0.0 114.884 -175.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.691 ' H ' ' CG ' ' A' ' 121' ' ' GLU . 18.9 t80 -49.94 -40.79 44.79 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 119.874 -1.766 . . . . 0.0 108.93 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.565 ' H ' ' CD ' ' A' ' 121' ' ' GLU . 1.1 mm -78.21 -27.17 14.53 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.831 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -67.48 -45.66 75.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.981 -1.074 . . . . 0.0 109.719 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' SER . . . . . 0.534 ' O ' ' N ' ' A' ' 130' ' ' LYS . 0.8 OUTLIER -63.2 -66.51 0.53 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.488 ' CD ' ' CE2' ' A' ' 112' ' ' PHE . 24.0 pt-20 -41.97 -33.2 0.52 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.489 -0.757 . . . . 0.0 109.318 -178.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.579 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . 4.8 mt -79.08 -32.17 44.64 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.111 -0.993 . . . . 0.0 109.056 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.534 ' N ' ' O ' ' A' ' 127' ' ' SER . 14.2 mttp . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.261 -0.9 . . . . 0.0 108.951 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' THR . . . . . 0.412 ' CG2' ' OD2' ' A' ' 97' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -133.49 121.79 22.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.38 -0.825 . . . . 0.0 109.314 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.2 tp -107.44 136.18 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.408 -0.807 . . . . 0.0 109.747 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 8' ' ' GLU . 1.9 p-10 -97.84 41.84 1.11 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -0.891 . . . . 0.0 109.041 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.431 ' C ' ' O ' ' A' ' 6' ' ' ASP . 1.3 mmtm -42.01 -18.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.346 -0.846 . . . . 0.0 109.898 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.5 mt-10 -51.96 -35.65 46.83 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.201 -0.937 . . . . 0.0 109.484 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.411 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -75.81 -63.67 1.25 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.863 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.65 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.49 -57.96 3.26 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.09 -1.006 . . . . 0.0 109.888 -179.439 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.65 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -44.16 -59.58 2.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.997 -1.064 . . . . 0.0 110.001 -179.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.9 -37.22 71.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.128 -0.983 . . . . 0.0 109.632 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.13 -11.13 59.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.12 -0.988 . . . . 0.0 109.852 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.476 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -81.88 -51.85 7.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.11 -0.994 . . . . 0.0 109.734 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.579 ' ND2' ' O ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -77.72 -11.25 59.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.247 -0.908 . . . . 0.0 109.64 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.526 ' C ' ' H ' ' A' ' 18' ' ' ARG . 58.3 tp -78.41 -50.06 12.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.207 -0.933 . . . . 0.0 109.34 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 m -57.87 -2.87 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.306 -0.871 . . . . 0.0 109.484 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.526 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.525 ' O ' ' CG1' ' A' ' 24' ' ' VAL . 55.7 t 53.02 57.16 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.269 -0.894 . . . . 0.0 109.482 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' A' ' 42' ' ' GLY . 6.9 tt -47.16 -36.45 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.906 -1.121 . . . . 0.0 108.865 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.615 ' CZ3' ' O ' ' A' ' 41' ' ' GLN . 57.9 p-90 -148.27 151.57 35.66 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.784 -1.197 . . . . 0.0 109.671 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.35 163.36 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.31 -0.869 . . . . 0.0 109.701 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.403 ' HG1' ' HB3' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -145.47 129.37 17.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.177 -0.952 . . . . 0.0 110.482 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.97 119.66 27.21 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 25.0 ptt180 -101.73 144.83 29.94 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -48.44 98.55 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.532 -0.73 . . . . 0.0 109.753 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -92.67 101.95 14.36 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.95 -119.28 15.55 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.094 -1.603 . . . . 0.0 109.094 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.34 24.95 12.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.546 -0.973 . . . . 0.0 110.146 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.4 m -146.36 132.59 19.46 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.151 -0.968 . . . . 0.0 109.982 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.584 ' CD1' ' N ' ' A' ' 36' ' ' ILE . 1.5 mp -79.95 113.12 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.175 -0.953 . . . . 0.0 108.515 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.46 152.13 75.92 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.196 -0.94 . . . . 0.0 110.16 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_exo -34.78 141.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.903 2.402 . . . . 0.0 112.471 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.78 -37.88 0.28 Allowed Glycine 0 N--CA 1.488 2.167 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.403 ' HB3' ' HG1' ' A' ' 28' ' ' THR . 0.2 OUTLIER -143.54 -179.49 6.47 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.615 ' O ' ' CZ3' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -130.79 -165.32 1.54 Allowed 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 121.49 0.662 . . . . 0.0 109.92 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.539 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . -139.36 101.61 0.32 Allowed Glycine 0 C--N 1.299 -1.497 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.531 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -136.9 50.99 1.99 Allowed 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.531 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 3.6 m-20 155.63 106.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.68 ' OH ' ' HE1' ' A' ' 64' ' ' PHE . 23.0 t80 -53.78 -14.69 1.0 Allowed 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.403 ' N ' ' C ' ' A' ' 44' ' ' ASP . 43.5 mm-40 -85.15 -40.73 16.4 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.012 -1.055 . . . . 0.0 109.893 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.4 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -61.66 -37.15 82.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.872 . . . . 0.0 110.334 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.623 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -59.12 -47.68 84.37 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.849 -1.157 . . . . 0.0 108.468 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.53 ' N ' ' CG ' ' A' ' 48' ' ' PHE . 1.7 mt -47.09 -43.72 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.396 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.9 pp0? -85.77 -10.06 56.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.95 -1.094 . . . . 0.0 110.481 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -86.95 8.15 24.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.96 -1.088 . . . . 0.0 109.771 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.581 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 4.8 p -130.7 55.09 1.85 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.341 -0.849 . . . . 0.0 109.477 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.588 ' C ' ' H ' ' A' ' 55' ' ' ASP . 9.5 p -73.45 159.48 33.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -0.945 . . . . 0.0 109.854 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.17 8.72 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.835 . . . . 0.0 110.156 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.588 ' H ' ' C ' ' A' ' 53' ' ' THR . 44.4 m-20 -116.84 21.8 13.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 109.57 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.524 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.2 OUTLIER -144.7 157.69 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.209 -0.932 . . . . 0.0 109.772 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.655 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -136.23 116.44 13.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.403 -0.81 . . . . 0.0 109.225 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.537 ' CD2' ' C ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -159.68 175.47 13.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.961 -1.087 . . . . 0.0 111.125 -179.357 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.56 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 3.5 m-85 -109.84 151.4 27.07 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.37 154.61 51.26 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.896 -1.128 . . . . 0.0 109.349 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.442 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 47.3 t80 -148.8 99.14 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.076 -1.015 . . . . 0.0 108.926 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -118.86 152.66 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.382 -0.824 . . . . 0.0 108.976 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.46 HH11 ' HG3' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -84.47 123.37 30.19 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.403 -0.811 . . . . 0.0 109.053 179.461 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.68 ' HE1' ' OH ' ' A' ' 45' ' ' TYR . 94.1 m-85 -108.14 156.23 19.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.415 -0.803 . . . . 0.0 109.356 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 98.2 m -78.49 161.01 27.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.153 -0.967 . . . . 0.0 109.12 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.6 t . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.383 -0.823 . . . . 0.0 109.454 179.947 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.414 ' HD2' HD13 ' A' ' 129' ' ' LEU . 5.0 mmtm -105.86 143.62 33.75 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.325 -0.859 . . . . 0.0 109.71 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.445 ' O ' ' N ' ' A' ' 109' ' ' ALA . 90.9 m-85 -133.53 117.74 17.48 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.362 -0.836 . . . . 0.0 109.121 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.531 ' CB ' ' O ' ' A' ' 110' ' ' LYS . . . -144.38 167.74 21.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.018 -1.051 . . . . 0.0 111.3 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.1 tp -114.16 156.48 24.16 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.6 mt -136.23 130.85 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.101 -0.999 . . . . 0.0 108.924 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.84 114.58 26.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.186 -0.946 . . . . 0.0 109.84 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.581 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 65.5 t-105 -93.35 112.38 24.28 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.579 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.81 93.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -48.21 156.39 1.12 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.54 -7.39 38.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -1.14 . . . . 0.0 109.698 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -102.9 21.11 16.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.227 -0.921 . . . . 0.0 109.583 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.671 ' CG1' ' H ' ' A' ' 87' ' ' SER . 4.8 t -86.28 -141.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.255 -0.903 . . . . 0.0 109.467 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.671 ' H ' ' CG1' ' A' ' 86' ' ' VAL . 10.0 m -150.27 -146.45 0.2 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.164 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.468 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -83.92 -17.28 65.76 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 90' ' ' GLN . 6.1 mp -46.5 -69.88 0.12 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.178 -1.189 . . . . 0.0 109.802 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.576 ' OE1' ' N ' ' A' ' 90' ' ' GLN . 3.3 mp0 -44.55 -29.65 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.121 -0.987 . . . . 0.0 109.229 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.468 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER -54.37 -64.5 0.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.12 -0.987 . . . . 0.0 109.737 -179.659 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 -44.11 38.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.161 -0.962 . . . . 0.0 109.707 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.35 -65.95 0.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.227 -0.921 . . . . 0.0 110.069 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.406 ' CB ' ' O ' ' A' ' 90' ' ' GLN . 2.1 m -51.86 -54.44 29.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.155 -0.966 . . . . 0.0 109.216 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.41 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.96 -62.84 2.5 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 p -64.58 -50.32 67.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.184 -1.186 . . . . 0.0 111.164 -178.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.412 ' OD2' ' CG2' ' A' ' 3' ' ' THR . 2.9 m-20 -66.46 -40.2 89.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.782 -1.199 . . . . 0.0 111.693 -177.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.62 -24.52 65.57 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 120.628 -1.295 . . . . 0.0 109.119 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -77.69 -39.42 44.82 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' A' ' 101' ' ' VAL . 11.6 mt -64.38 -61.46 2.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.404 -0.81 . . . . 0.0 109.044 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.452 ' C ' ' O ' ' A' ' 100' ' ' LEU . 42.7 t -38.88 -55.83 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 110.262 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 103' ' ' GLU . 76.9 tttt -65.39 -43.56 90.28 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.105 -0.997 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.425 ' C ' ' O ' ' A' ' 102' ' ' LYS . 1.4 tt0 -36.58 -33.64 0.05 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.487 -0.758 . . . . 0.0 111.293 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.494 ' CG2' ' O ' ' A' ' 104' ' ' VAL . 10.9 p -127.51 34.91 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.107 -0.996 . . . . 0.0 110.839 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.509 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 0.6 OUTLIER -115.07 119.9 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.93 . . . . 0.0 109.018 179.063 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.04 -27.58 1.82 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.248 -0.908 . . . . 0.0 109.388 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -51.89 -34.51 41.57 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.301 -0.874 . . . . 0.0 109.289 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -176.49 1.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.156 -0.965 . . . . 0.0 109.782 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.445 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -125.01 -29.41 3.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.521 -0.737 . . . . 0.0 109.235 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 77' ' ' ALA . 0.2 OUTLIER -159.16 140.69 13.19 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.0 109.348 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.562 ' H ' ' CD ' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -105.01 151.12 24.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.27 -0.894 . . . . 0.0 109.14 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -136.03 157.08 47.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.283 -0.886 . . . . 0.0 110.249 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.4 104.37 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 38.5 mm -97.83 151.43 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.184 -0.947 . . . . 0.0 109.816 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.54 5.51 2.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.351 -0.843 . . . . 0.0 109.257 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -135.21 154.58 51.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.578 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -69.52 -42.37 74.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 109.739 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -75.59 -4.18 38.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.153 -0.967 . . . . 0.0 109.294 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.588 ' OE2' ' CE1' ' A' ' 124' ' ' PHE . 9.9 mm-40 -86.4 0.54 53.84 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.248 -0.907 . . . . 0.0 109.618 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.1 mt -104.84 14.58 29.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.278 -0.889 . . . . 0.0 109.041 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -68.71 140.48 55.4 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.496 -0.752 . . . . 0.0 109.675 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -53.37 -53.02 57.18 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.875 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.78 69.24 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.173 -0.955 . . . . 0.0 109.692 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CE1' ' OE2' ' A' ' 119' ' ' GLU . 78.8 t80 -63.15 -47.71 81.55 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 122.008 0.909 . . . . 0.0 108.977 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.3 mm -74.4 -23.59 18.33 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 122' ' ' GLU . 13.9 ttm180 -65.58 -55.52 17.2 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.341 -0.85 . . . . 0.0 109.504 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -23.22 65.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.14 -39.75 17.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.414 HD13 ' HD2' ' A' ' 75' ' ' LYS . 2.8 mt -69.86 -24.1 63.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.27 -0.894 . . . . 0.0 108.923 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.303 -1.413 0 O-C-N 121.281 -0.887 . . . . 0.0 108.678 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.63 129.34 36.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.391 -0.818 . . . . 0.0 109.452 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.3 tp -107.53 135.26 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.835 . . . . 0.0 109.692 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.538 ' O ' ' N ' ' A' ' 8' ' ' GLU . 83.8 m-20 -98.1 49.12 1.0 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.443 ' CE ' ' O ' ' A' ' 104' ' ' VAL . 0.1 OUTLIER -40.44 -24.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.459 -0.776 . . . . 0.0 109.804 -179.409 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -47.49 -39.31 15.68 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.148 -0.97 . . . . 0.0 109.046 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.75 3.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.329 -0.857 . . . . 0.0 109.399 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -52.34 -69.46 0.11 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.124 -0.985 . . . . 0.0 109.536 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.407 ' C ' ' O ' ' A' ' 10' ' ' CYS . 19.2 ttt180 -44.3 -57.64 3.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.858 -1.151 . . . . 0.0 109.378 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.6 -52.77 53.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -19.17 65.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.408 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.65 ' CE2' ' CE1' ' A' ' 61' ' ' PHE . 0.2 OUTLIER -73.72 -56.3 5.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.373 -0.829 . . . . 0.0 109.721 -179.497 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.681 HD21 HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -77.77 -17.88 57.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.332 -0.855 . . . . 0.0 109.918 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.03 -39.27 86.98 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.125 -0.984 . . . . 0.0 109.356 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.45 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.0 m -70.98 -4.57 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.182 -0.949 . . . . 0.0 109.511 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.24 -0.912 . . . . 0.0 109.404 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.284 0.564 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.551 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -105.67 119.09 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.407 -0.808 . . . . 0.0 109.554 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.445 HG21 ' H ' ' A' ' 26' ' ' TRP . 9.9 tt -48.26 -39.79 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.023 -1.048 . . . . 0.0 108.946 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.607 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 34.5 p-90 -156.24 150.68 25.67 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.872 -1.143 . . . . 0.0 110.371 178.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -116.05 152.39 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.445 -0.785 . . . . 0.0 109.479 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.536 ' O ' ' N ' ' A' ' 39' ' ' GLY . 5.9 p -129.76 135.56 48.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.442 -0.786 . . . . 0.0 110.035 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -124.15 119.15 28.59 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -100.34 147.79 25.41 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.634 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.589 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 12.3 m-85 -49.49 98.97 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.552 -0.718 . . . . 0.0 110.113 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.71 101.54 13.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.09 -121.0 23.39 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.22 22.09 16.43 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.392 -1.063 . . . . 0.0 110.081 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.0 m -142.72 132.36 23.88 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.28 -0.888 . . . . 0.0 110.042 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.5 mp -79.12 114.98 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.349 -0.844 . . . . 0.0 108.956 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -135.55 151.88 75.33 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.389 -0.819 . . . . 0.0 109.804 -179.322 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.412 ' C ' ' O ' ' A' ' 37' ' ' VAL . 90.3 Cg_exo -34.57 149.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.653 2.236 . . . . 0.0 111.744 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -136.53 -44.35 0.09 OUTLIER Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.573 ' CG ' HE22 ' A' ' 51' ' ' GLN . 0.7 OUTLIER -143.02 -178.86 6.04 Favored 'General case' 0 C--N 1.294 -1.808 0 O-C-N 121.672 -0.899 . . . . 0.0 109.157 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.613 ' NE2' ' CE1' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -144.85 -166.97 2.54 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.441 -0.787 . . . . 0.0 109.789 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -166.82 134.45 3.28 Favored Glycine 0 N--CA 1.487 2.051 0 N-CA-C 109.654 -1.379 . . . . 0.0 109.654 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.14 -5.55 19.27 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -158.2 176.11 12.91 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.505 ' CE2' ' CE2' ' A' ' 48' ' ' PHE . 1.6 t80 -73.79 -44.74 55.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.012 -1.055 . . . . 0.0 109.55 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 45' ' ' TYR . 21.7 mm-40 -42.29 -37.89 1.65 Allowed 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.263 -0.898 . . . . 0.0 110.274 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.613 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 3.5 t-160 -60.99 -43.67 98.51 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.061 -1.024 . . . . 0.0 109.781 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.619 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -49.47 -33.99 15.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.133 -0.979 . . . . 0.0 108.707 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.4 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.7 mt -64.36 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.419 -0.8 . . . . 0.0 111.203 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.554 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 2.6 tm0? -85.72 -13.63 47.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.658 -1.276 . . . . 0.0 107.951 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.573 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -96.52 -6.56 36.75 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.583 -178.692 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.57 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 16.8 p -123.37 54.08 1.29 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.416 -0.803 . . . . 0.0 110.317 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 55' ' ' ASP . 40.9 p -75.48 155.1 36.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.856 -1.152 . . . . 0.0 109.42 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 p30 -71.77 12.58 0.36 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.768 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.49 ' H ' ' C ' ' A' ' 53' ' ' THR . 13.0 t70 -97.67 -0.19 46.01 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.171 -0.955 . . . . 0.0 110.169 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.414 HG22 ' H ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.41 176.07 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 120.909 -1.119 . . . . 0.0 110.634 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.461 ' NE ' ' CG1' ' A' ' 86' ' ' VAL . 5.5 ptp180 -138.96 134.75 33.56 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.515 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.5 pp -168.6 172.34 8.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.369 -0.832 . . . . 0.0 109.172 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -105.44 152.73 22.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -0.981 . . . . 0.0 109.282 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -130.17 153.56 48.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.418 -0.801 . . . . 0.0 108.998 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.65 ' CE1' ' CE2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -136.78 107.76 6.7 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.395 -0.815 . . . . 0.0 109.038 -179.583 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.1 143.32 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.393 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -83.12 115.89 22.09 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -93.76 155.72 17.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.232 -0.917 . . . . 0.0 110.171 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.57 149.16 34.88 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.505 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 109.547 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HE2' ' HA ' ' A' ' 66' ' ' THR . 8.2 mttm -105.02 150.55 24.86 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.35 -0.844 . . . . 0.0 109.673 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.553 ' O ' ' N ' ' A' ' 109' ' ' ALA . 89.1 m-85 -133.36 117.81 17.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.44 -0.788 . . . . 0.0 109.119 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.71 165.14 28.49 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.973 -1.079 . . . . 0.0 111.456 -178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.446 HD11 ' H ' ' A' ' 79' ' ' ILE . 11.7 tp -108.89 145.72 34.91 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.446 ' H ' HD11 ' A' ' 78' ' ' LEU . 19.6 mt -131.33 141.44 45.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 120.85 -1.156 . . . . 0.0 108.846 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.0 m -112.62 124.83 53.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.063 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.564 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 60.8 t-105 -96.83 113.34 24.88 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.989 -1.069 . . . . 0.0 109.832 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mm -111.21 93.25 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -74.58 162.79 54.19 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 -179.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -110.46 66.97 0.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.627 -0.926 . . . . 0.0 109.689 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.448 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.2 t0 -169.41 -46.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.218 -0.926 . . . . 0.0 109.552 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.461 ' CG1' ' NE ' ' A' ' 57' ' ' ARG . 7.4 p -41.62 157.49 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.291 -0.881 . . . . 0.0 109.951 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.1 p -61.09 173.55 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.414 -0.804 . . . . 0.0 109.971 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.38 -21.49 56.49 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.63 -69.77 0.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.122 -1.222 . . . . 0.0 110.017 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 84.1 mm-40 -49.14 -22.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.81 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 1.7 ttp180 -55.85 -44.13 77.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.808 -1.183 . . . . 0.0 109.436 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.83 -35.66 62.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.234 -0.916 . . . . 0.0 109.894 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.408 ' O ' ' C ' ' A' ' 94' ' ' THR . 10.6 mmmt -74.71 -48.44 25.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -0.919 . . . . 0.0 109.358 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.589 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 35.3 m -45.2 -59.5 2.6 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.348 -0.845 . . . . 0.0 109.422 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.73 -59.99 4.03 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 p -63.21 -51.45 66.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.986 -1.302 . . . . 0.0 110.521 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -58.45 -45.87 87.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.016 -1.052 . . . . 0.0 110.631 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -51.22 -31.16 19.61 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.847 -1.158 . . . . 0.0 108.24 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.44 -41.18 96.79 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.0 mt -48.12 -57.97 5.13 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.578 ' C ' ' H ' ' A' ' 103' ' ' GLU . 4.5 t -56.47 -50.72 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -65.02 7.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.578 ' H ' ' C ' ' A' ' 101' ' ' VAL . 3.0 tt0 -99.77 -44.55 6.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -0.792 . . . . 0.0 109.368 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.527 ' CG1' ' O ' ' A' ' 104' ' ' VAL . 53.4 t -123.02 62.93 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.439 -0.788 . . . . 0.0 109.863 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.535 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 4.1 p -132.63 115.22 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.999 -1.063 . . . . 0.0 110.361 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.636 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -125.2 -36.54 2.5 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.181 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.681 HD21 HD21 ' A' ' 15' ' ' ASN . 8.3 m-20 -60.84 32.05 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.928 -0.482 . . . . 0.0 110.245 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.636 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -139.43 139.19 37.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 0.0 109.085 179.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -78.84 -35.58 43.78 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.172 -0.955 . . . . 0.0 109.41 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -162.65 157.72 22.24 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.27 -0.894 . . . . 0.0 109.456 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.73 156.45 17.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 108.922 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -139.14 154.92 48.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.136 -0.978 . . . . 0.0 110.104 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 6.7 p -119.5 157.76 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 2.4 mm -136.33 148.23 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.183 -0.948 . . . . 0.0 109.826 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.53 -3.92 2.97 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.548 ' O ' ' N ' ' A' ' 119' ' ' GLU . 0.1 OUTLIER -157.76 133.61 9.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.298 -0.876 . . . . 0.0 109.51 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.415 ' C ' ' O ' ' A' ' 116' ' ' ASP . 25.4 ttp180 -44.25 -25.37 0.23 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.254 -0.903 . . . . 0.0 109.625 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 116' ' ' ASP . 16.3 tttt -75.82 -18.56 59.43 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.174 -0.954 . . . . 0.0 109.359 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 59.4 mt-10 -86.28 -3.38 58.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.335 -0.853 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -105.27 31.41 4.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.176 -0.953 . . . . 0.0 108.866 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -83.04 155.1 24.09 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.509 -0.744 . . . . 0.0 109.783 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.15 -50.77 60.05 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.112 -0.993 . . . . 0.0 109.44 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.3 -15.3 9.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.891 . . . . 0.0 109.936 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.608 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 15.0 t80 -84.8 -49.28 8.57 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 0.0 109.184 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.547 ' CG2' HD12 ' A' ' 129' ' ' LEU . 3.0 mt -77.99 -11.88 13.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.802 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.14 -55.86 5.07 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.346 -0.846 . . . . 0.0 108.87 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -17.54 64.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.264 -0.897 . . . . 0.0 109.461 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.439 ' CA ' ' OE1' ' A' ' 128' ' ' GLU . 0.1 OUTLIER -84.74 -40.14 17.64 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.336 -0.852 . . . . 0.0 109.364 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.547 HD12 ' CG2' ' A' ' 125' ' ' ILE . 2.5 mt -79.24 -7.97 58.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.29 -0.881 . . . . 0.0 109.724 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.05 -1.031 . . . . 0.0 108.942 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.3 0.571 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 mmtp -136.73 118.61 15.19 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.0 109.427 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -107.07 142.29 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.304 -0.873 . . . . 0.0 109.895 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.442 ' O ' ' C ' ' A' ' 7' ' ' LYS . 9.7 m-20 -90.25 44.5 1.2 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.301 -0.874 . . . . 0.0 108.974 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.674 ' HZ1' ' CB ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -38.68 -31.13 0.05 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.613 -0.679 . . . . 0.0 110.336 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' A' ' 6' ' ' ASP . 31.4 mt-10 -55.06 -51.22 67.03 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.22 -0.925 . . . . 0.0 110.307 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.96 -69.38 0.18 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.131 -0.981 . . . . 0.0 110.368 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -44.74 -57.89 3.42 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.218 -0.926 . . . . 0.0 110.465 -179.168 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.577 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 19.3 ttt180 -44.99 -58.54 3.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.93 -1.106 . . . . 0.0 110.266 -178.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.06 -46.42 82.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.218 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.39 -10.54 59.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.046 -1.034 . . . . 0.0 110.348 -179.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.5 m-85 -81.31 -54.2 5.68 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.709 HD21 HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -75.99 -14.41 60.23 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.188 -0.945 . . . . 0.0 109.461 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.558 ' C ' ' H ' ' A' ' 18' ' ' ARG . 5.2 tt -73.48 -51.48 16.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.379 -0.825 . . . . 0.0 109.474 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.582 ' O ' ' NH2' ' A' ' 63' ' ' ARG . 3.3 p -55.37 -4.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.206 -0.934 . . . . 0.0 109.524 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.558 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.303 -1.418 0 O-C-N 121.303 -0.873 . . . . 0.0 109.453 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.34 0.591 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.539 ' O ' ' CG1' ' A' ' 24' ' ' VAL . 75.7 t 47.24 52.28 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.162 -0.961 . . . . 0.0 109.365 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.44 ' N ' ' O ' ' A' ' 42' ' ' GLY . 12.8 tt -46.26 -29.78 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 120.824 -1.172 . . . . 0.0 108.575 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.619 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 32.2 p-90 -156.17 150.94 26.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.879 -1.138 . . . . 0.0 110.076 177.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.24 144.84 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.535 -0.728 . . . . 0.0 109.797 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.4 p -138.11 132.73 32.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.42 -0.8 . . . . 0.0 109.77 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.24 145.15 47.31 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.46 ' O ' ' N ' ' A' ' 32' ' ' ASP . 24.7 ptt180 -119.49 141.29 49.31 Favored 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 119.765 -0.774 . . . . 0.0 109.95 -178.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.47 ' HH ' ' C ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -41.28 98.44 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.718 -0.614 . . . . 0.0 109.783 -179.422 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -91.47 101.99 14.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.884 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 54.11 -116.51 6.31 Favored Glycine 0 N--CA 1.487 2.087 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.52 25.3 11.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.391 -1.064 . . . . 0.0 110.211 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.7 m -146.31 133.91 20.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.193 -0.942 . . . . 0.0 109.816 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.1 mp -81.72 111.98 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.031 -1.043 . . . . 0.0 108.73 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.45 152.49 76.6 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.347 -0.846 . . . . 0.0 109.977 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -39.16 140.44 0.48 Allowed 'Trans proline' 0 C--N 1.311 -1.409 0 C-N-CA 122.659 2.239 . . . . 0.0 112.249 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.18 -33.49 0.36 Allowed Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.509 ' CB ' HE22 ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.12 -177.93 5.59 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.644 ' NE2' ' HD1' ' A' ' 47' ' ' HIS . 0.3 OUTLIER -138.44 -176.94 4.64 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-O 121.821 0.82 . . . . 0.0 110.387 -179.826 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.44 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . -119.66 83.71 0.36 Allowed Glycine 0 N--CA 1.479 1.556 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.607 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -104.71 56.38 0.7 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.643 -0.916 . . . . 0.0 108.53 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.607 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 33.5 t0 120.21 140.84 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -179.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -56.86 -47.36 80.6 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.067 -1.021 . . . . 0.0 108.462 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -53.27 -34.87 59.05 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.345 -0.847 . . . . 0.0 109.416 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.644 ' HD1' ' NE2' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -53.21 -28.95 29.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.0 108.896 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.24 -34.98 75.66 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mt -76.29 -13.97 14.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.222 -0.924 . . . . 0.0 109.553 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.525 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 26.4 tp60 -87.67 -50.41 6.51 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.105 -0.997 . . . . 0.0 109.411 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.509 HE22 ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -108.07 55.97 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.64 -0.662 . . . . 0.0 111.145 -178.183 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.1 t -162.32 62.66 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.082 -1.011 . . . . 0.0 109.184 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.583 ' O ' ' N ' ' A' ' 55' ' ' ASP . 2.5 p -87.54 154.68 20.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.404 -0.81 . . . . 0.0 109.916 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -46.14 -11.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.856 . . . . 0.0 109.652 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 53' ' ' THR . 1.9 t70 -93.27 35.37 1.09 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.202 -0.936 . . . . 0.0 109.403 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.581 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 53.3 t -145.4 145.3 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.282 -0.886 . . . . 0.0 109.45 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.638 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.51 122.98 27.08 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.48 -0.762 . . . . 0.0 109.68 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.594 ' O ' ' N ' ' A' ' 81' ' ' TRP . 4.1 pp -172.84 -170.93 0.71 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.934 -1.104 . . . . 0.0 110.718 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.623 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -118.32 153.61 33.69 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.213 -0.929 . . . . 0.0 109.145 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -136.31 156.35 48.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.791 -1.193 . . . . 0.0 109.309 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -149.56 103.35 3.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.16 -0.962 . . . . 0.0 109.375 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -118.37 154.37 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.241 -0.912 . . . . 0.0 109.602 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.582 ' NH2' ' O ' ' A' ' 17' ' ' VAL . 14.4 ttp180 -84.61 130.73 34.69 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -118.26 157.1 27.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.439 -0.788 . . . . 0.0 109.83 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.58 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . 8.7 t -97.0 140.96 30.75 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.314 -0.866 . . . . 0.0 109.044 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.4 -0.813 . . . . 0.0 109.614 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.0 p . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.58 ' NZ ' ' O ' ' A' ' 65' ' ' THR . 4.2 pttm -107.32 130.93 54.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.364 -0.835 . . . . 0.0 109.215 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.545 ' O ' ' N ' ' A' ' 109' ' ' ALA . 98.9 m-85 -103.82 129.3 51.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 110.275 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.57 161.95 37.82 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.126 -0.984 . . . . 0.0 111.241 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.8 157.44 25.56 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.9 mt -137.55 143.38 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 120.843 -1.161 . . . . 0.0 109.309 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.596 ' N ' ' O ' ' A' ' 112' ' ' PHE . 0.2 OUTLIER -100.82 114.83 28.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.162 -0.961 . . . . 0.0 109.03 179.636 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.597 ' CH2' ' O ' ' A' ' 115' ' ' SER . 73.5 t-105 -92.81 110.49 21.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.142 -0.973 . . . . 0.0 109.785 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.483 ' O ' ' OG ' ' A' ' 115' ' ' SER . 8.1 mm -114.88 92.5 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.03 161.09 0.05 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -88.36 -20.27 25.55 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -1.109 . . . . 0.0 109.457 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.49 41.46 1.23 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 109.505 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 52.0 t -96.83 161.98 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.228 -0.92 . . . . 0.0 109.732 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.9 t -95.32 -162.47 0.95 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.253 -0.904 . . . . 0.0 109.42 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.06 -18.12 63.69 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.5 mt -46.69 -60.86 2.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.912 -1.346 . . . . 0.0 109.79 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.45 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 22.3 mm-40 -56.8 -30.76 64.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.006 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -50.93 -62.32 1.68 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.924 -1.11 . . . . 0.0 109.916 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.99 -44.04 15.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.161 -0.962 . . . . 0.0 110.014 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.47 ' C ' ' HH ' ' A' ' 31' ' ' TYR . 21.3 mtpt -58.43 -58.93 6.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.207 -0.933 . . . . 0.0 110.007 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.442 ' OG1' ' CD ' ' A' ' 90' ' ' GLN . 2.1 m -57.19 -40.82 78.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.111 -0.993 . . . . 0.0 109.487 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -43.72 -59.61 3.67 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.164 -1.175 . . . . 0.0 110.164 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.569 ' HG1' ' N ' ' A' ' 97' ' ' ASP . 24.9 p -63.8 -42.88 97.63 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.072 -1.252 . . . . 0.0 110.845 -178.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.569 ' N ' ' HG1' ' A' ' 96' ' ' THR . 1.7 t0 -65.0 -44.18 90.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.852 -1.155 . . . . 0.0 111.192 -178.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -26.56 45.88 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.683 -1.261 . . . . 0.0 108.899 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -50.78 48.67 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.431 -0.793 . . . . 0.0 109.275 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.413 ' O ' ' C ' ' A' ' 101' ' ' VAL . 8.5 mp -57.3 -59.49 5.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.413 ' C ' ' O ' ' A' ' 100' ' ' LEU . 21.8 t -44.46 -69.18 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.847 . . . . 0.0 109.409 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 ttpp -48.61 -47.79 39.74 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.466 -0.771 . . . . 0.0 110.046 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.86 -31.55 71.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 111.013 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.7 p -106.28 13.71 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.096 -1.003 . . . . 0.0 110.747 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.493 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -108.39 124.43 64.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.102 -0.999 . . . . 0.0 109.829 179.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.671 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -126.51 -30.21 2.86 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 179.572 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.709 HD21 HD21 ' A' ' 15' ' ' ASN . 2.2 t-20 -62.39 29.27 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.537 -0.727 . . . . 0.0 109.93 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.671 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -141.95 160.85 39.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.153 -0.967 . . . . 0.0 109.238 179.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.545 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -95.66 -37.97 10.58 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.824 . . . . 0.0 109.609 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.29 159.83 36.38 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 109.438 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.75 160.48 14.94 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 109.172 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.596 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.9 m-85 -138.54 149.71 45.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.286 -0.884 . . . . 0.0 109.875 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 58.6 t -114.67 118.73 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.525 -0.734 . . . . 0.0 109.036 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.763 HG21 ' OE2' ' A' ' 119' ' ' GLU . 7.2 mt -138.55 158.62 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.0 110.289 -179.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.597 ' O ' ' CH2' ' A' ' 81' ' ' TRP . 11.2 t -134.1 -46.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.95 155.57 23.95 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.59 -0.694 . . . . 0.0 109.619 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -79.62 -17.82 52.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.107 -0.995 . . . . 0.0 109.841 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 60.4 tttt -73.51 -33.47 64.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.003 . . . . 0.0 109.832 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.763 ' OE2' HG21 ' A' ' 114' ' ' ILE . 0.3 OUTLIER -86.34 5.02 36.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.062 -1.024 . . . . 0.0 109.853 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 tt -104.26 0.45 29.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.166 -0.959 . . . . 0.0 109.188 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -49.5 139.36 12.22 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.428 -0.795 . . . . 0.0 109.798 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.1 OUTLIER -52.08 -53.81 37.89 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 109.878 -179.871 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . 0.401 ' OD1' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.01 -48.81 72.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.096 -1.002 . . . . 0.0 109.825 -179.265 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 65.9 t80 -48.48 -42.69 33.53 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 122.203 1.001 . . . . 0.0 109.073 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -76.11 -24.28 16.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.908 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.7 ttp180 -65.1 -55.71 17.18 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.238 -0.914 . . . . 0.0 109.107 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.0 t -62.52 -21.4 65.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -76.55 -41.74 45.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.436 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.3 mt -69.14 -38.7 78.96 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.154 -0.966 . . . . 0.0 108.56 179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? . . . . . 0 C--N 1.305 -1.362 0 O-C-N 121.153 -0.967 . . . . 0.0 108.567 178.891 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -130.18 135.95 48.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.394 -0.816 . . . . 0.0 109.48 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.9 tp -118.46 130.28 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.47 -0.769 . . . . 0.0 109.335 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.504 ' O ' ' N ' ' A' ' 8' ' ' GLU . 5.6 m-20 -91.73 39.68 1.02 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.118 -0.989 . . . . 0.0 109.051 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.643 ' HZ3' ' CA ' ' A' ' 104' ' ' VAL . 3.5 mttt -42.43 -23.34 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.813 -179.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.567 ' OE1' ' N ' ' A' ' 8' ' ' GLU . 39.3 mp0 -50.11 -35.46 25.69 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.093 -1.005 . . . . 0.0 108.364 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.42 -46.02 13.01 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.57 ' O ' ' N ' ' A' ' 14' ' ' TYR . 13.0 t -60.67 -66.17 0.57 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.242 -0.911 . . . . 0.0 109.489 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.484 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 32.0 ttp180 -44.19 -56.24 4.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.756 -1.215 . . . . 0.0 109.882 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.13 -28.07 67.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.01 -1.056 . . . . 0.0 109.762 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.5 -58.22 2.63 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.073 -1.017 . . . . 0.0 109.605 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.661 ' CD1' ' CD1' ' A' ' 61' ' ' PHE . 5.9 t80 -45.16 -51.18 10.76 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.301 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.536 ' N ' ' ND2' ' A' ' 15' ' ' ASN . 0.3 OUTLIER -71.22 -45.04 64.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.023 -1.048 . . . . 0.0 110.248 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.554 ' C ' ' H ' ' A' ' 18' ' ' ARG . 20.6 tp -41.54 -48.64 3.98 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.076 -1.015 . . . . 0.0 110.063 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 1.2 m -53.85 -4.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.062 -1.024 . . . . 0.0 109.898 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.554 ' H ' ' C ' ' A' ' 16' ' ' LEU . 6.8 ttm180 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.149 -0.97 . . . . 0.0 109.285 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.484 ' O ' ' CG2' ' A' ' 24' ' ' VAL . 4.6 p 35.39 57.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.676 -0.64 . . . . 0.0 110.458 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.468 HG21 ' H ' ' A' ' 26' ' ' TRP . 6.9 tt -42.92 -41.63 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.173 -0.954 . . . . 0.0 109.267 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.583 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 43.2 p-90 -149.25 166.78 27.89 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 120.992 -1.067 . . . . 0.0 110.261 178.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.402 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 18.3 m -137.68 141.81 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.891 . . . . 0.0 109.329 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.5 p -129.17 140.19 51.61 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 109.877 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.99 125.27 44.93 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -100.08 148.39 24.61 Favored 'General case' 0 C--N 1.296 -1.722 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.334 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.433 ' CD1' ' NE2' ' A' ' 90' ' ' GLN . 23.0 m-85 -57.87 98.7 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.558 -0.714 . . . . 0.0 109.779 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.61 102.07 13.47 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.28 -126.14 9.18 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.95 17.9 21.26 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.41 -1.053 . . . . 0.0 110.041 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.8 m -138.23 136.4 36.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.244 -0.91 . . . . 0.0 110.042 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.521 ' CD1' ' OD1' ' A' ' 97' ' ' ASP . 4.3 mp -79.78 115.36 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.38 150.83 73.56 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 109.937 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -34.56 152.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.376 0 C-N-CA 122.89 2.393 . . . . 0.0 112.324 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.29 -53.25 0.07 OUTLIER Glycine 0 N--CA 1.489 2.207 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.582 ' OD1' ' N ' ' A' ' 41' ' ' GLN . 14.1 t70 -143.28 179.53 7.03 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.713 -0.875 . . . . 0.0 108.976 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.583 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -140.98 -165.98 2.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 110.057 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.06 131.65 2.5 Favored Glycine 0 N--CA 1.486 1.969 0 N-CA-C 109.864 -1.295 . . . . 0.0 109.864 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.83 -5.06 21.51 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -148.3 164.84 32.81 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.56 ' C ' ' CD1' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -78.48 -11.4 59.95 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.033 -1.042 . . . . 0.0 109.585 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.54 -31.23 63.55 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.057 -1.027 . . . . 0.0 109.759 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.448 ' O ' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.47 -51.84 32.3 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.978 -1.076 . . . . 0.0 109.751 -179.666 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.626 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -43.25 -36.75 1.9 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.548 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.402 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mm -63.65 -41.31 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.339 -0.85 . . . . 0.0 110.455 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.543 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 1.6 tm0? -87.06 -15.74 37.67 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.489 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER -99.25 61.47 1.22 Allowed 'General case' 0 C--N 1.3 -1.579 0 CA-C-O 122.261 1.029 . . . . 0.0 109.925 -179.089 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.553 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 14.3 p -179.86 56.63 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.27 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.555 ' O ' ' NE1' ' A' ' 81' ' ' TRP . 3.1 p -77.87 156.01 30.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.058 -1.026 . . . . 0.0 110.025 -179.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.13 12.35 0.57 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.815 . . . . 0.0 109.847 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.455 ' H ' ' C ' ' A' ' 53' ' ' THR . 20.9 m-20 -97.89 1.21 47.85 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.199 -0.938 . . . . 0.0 109.74 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.419 HG21 ' H ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.34 -179.65 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.043 -1.036 . . . . 0.0 110.293 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.419 ' H ' HG21 ' A' ' 56' ' ' VAL . 5.2 ptp180 -140.17 138.64 35.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.32 -0.862 . . . . 0.0 110.024 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.497 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.7 pp -172.22 169.09 5.54 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.418 -0.802 . . . . 0.0 109.409 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -101.02 153.02 19.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.028 -1.045 . . . . 0.0 109.081 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.94 152.31 42.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.302 -0.874 . . . . 0.0 109.045 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.661 ' CD1' ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -140.47 96.34 3.02 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.413 -0.805 . . . . 0.0 109.087 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.5 ' O ' ' CE2' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -133.99 129.87 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 120.735 -1.228 . . . . 0.0 109.869 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.619 ' HE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ptm180 -68.16 142.86 55.6 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.175 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.5 ' CE2' ' O ' ' A' ' 62' ' ' VAL . 97.9 m-85 -118.79 155.92 30.3 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.796 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 m -81.75 131.43 35.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.157 -0.965 . . . . 0.0 109.037 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 66' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.353 -0.842 . . . . 0.0 109.484 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.619 ' CB ' ' HE ' ' A' ' 63' ' ' ARG . 21.0 p . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.189 0.519 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.494 ' NZ ' ' CD2' ' A' ' 129' ' ' LEU . 3.7 ttpt -104.59 170.2 8.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.443 -0.786 . . . . 0.0 109.08 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.522 ' O ' ' N ' ' A' ' 109' ' ' ALA . 79.1 m-85 -134.06 126.78 30.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.126 -0.984 . . . . 0.0 111.289 -178.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.79 166.6 24.79 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.518 -0.739 . . . . 0.0 110.439 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.1 tt -113.85 151.43 32.14 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.6 mt -128.22 131.93 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 120.949 -1.094 . . . . 0.0 109.563 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.5 m -100.98 124.61 46.96 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.348 -0.845 . . . . 0.0 109.831 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.555 ' NE1' ' O ' ' A' ' 53' ' ' THR . 58.0 t-105 -102.45 111.96 24.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.175 -0.953 . . . . 0.0 109.831 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mm -109.86 93.35 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.26 153.95 48.03 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -104.63 56.26 0.71 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.63 -0.923 . . . . 0.0 109.612 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 86' ' ' VAL . 7.9 t70 -158.59 -39.02 0.06 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.217 -0.927 . . . . 0.0 109.528 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.435 ' C ' ' O ' ' A' ' 85' ' ' ASP . 12.6 p -40.87 156.97 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.981 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.95 -176.1 0.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.312 -0.868 . . . . 0.0 109.54 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.459 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.35 -22.76 53.46 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -46.68 -70.03 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.153 -1.204 . . . . 0.0 110.074 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.433 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 17.3 mt-30 -48.06 -21.71 0.5 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 109.82 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.459 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 5.7 ttt180 -58.66 -45.26 89.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.966 -1.084 . . . . 0.0 109.578 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.48 -37.4 56.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.247 -0.908 . . . . 0.0 109.793 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 94' ' ' THR . 4.4 mttm -73.71 -52.94 11.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.154 -0.966 . . . . 0.0 109.539 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.411 ' C ' ' O ' ' A' ' 93' ' ' LYS . 59.6 m -45.34 -56.02 5.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -44.38 -60.2 3.76 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -63.79 -50.73 67.83 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.974 -1.309 . . . . 0.0 110.223 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.521 ' OD1' ' CD1' ' A' ' 36' ' ' ILE . 3.4 t70 -57.14 -47.05 82.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.989 -1.069 . . . . 0.0 110.283 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 97' ' ' ASP . 6.1 ptmt -47.62 -33.32 6.52 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.839 -1.145 . . . . 0.0 107.984 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.7 m -59.87 -40.33 88.29 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.487 ' N ' ' O ' ' A' ' 97' ' ' ASP . 95.6 mt -49.75 -60.4 2.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.582 ' C ' ' H ' ' A' ' 103' ' ' GLU . 21.6 t -53.36 -46.62 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -65.44 7.85 0.19 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.582 ' H ' ' C ' ' A' ' 101' ' ' VAL . 19.8 tt0 -100.05 -44.58 5.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.427 -0.796 . . . . 0.0 110.325 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.643 ' CA ' ' HZ3' ' A' ' 7' ' ' LYS . 77.2 t -126.01 60.05 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.233 -0.917 . . . . 0.0 110.839 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.405 HG22 ' HZ2' ' A' ' 7' ' ' LYS . 4.2 t -130.52 96.94 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.075 -1.016 . . . . 0.0 109.56 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.615 ' C ' ' H ' ' A' ' 108' ' ' PHE . 35.0 mt-30 -120.2 -35.67 3.4 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.444 ' CG ' ' O ' ' A' ' 107' ' ' ASN . 36.6 t30 -62.53 35.45 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.7 -0.625 . . . . 0.0 110.298 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.615 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -139.14 150.69 45.93 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.164 -0.96 . . . . 0.0 108.983 178.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.522 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -79.48 -44.27 21.6 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.331 -0.856 . . . . 0.0 109.502 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -160.87 159.51 29.87 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.143 -0.973 . . . . 0.0 109.481 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.62 157.41 17.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.25 -0.906 . . . . 0.0 109.164 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -117.75 142.35 47.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.643 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.8 t -110.6 97.03 5.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.427 HD13 HG22 ' A' ' 114' ' ' ILE . 10.3 mm -103.47 152.32 6.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 O-C-N 121.3 -0.875 . . . . 0.0 110.828 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.5 p -139.77 5.37 2.17 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -160.46 155.39 24.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.386 -0.821 . . . . 0.0 109.271 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 20.7 mtm180 -67.08 -24.12 65.93 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 0.0 109.769 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -69.33 -23.03 63.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.0 109.216 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.421 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 30.0 mt-10 -86.56 -1.89 58.02 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.389 -0.819 . . . . 0.0 109.648 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.9 mt -107.08 25.54 11.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.257 -0.902 . . . . 0.0 109.429 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -82.98 146.32 28.85 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.403 -0.811 . . . . 0.0 109.646 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 1.003 ' HB2' ' NH2' ' A' ' 126' ' ' ARG . 0.2 OUTLIER -52.56 -55.32 23.04 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.132 -0.98 . . . . 0.0 109.338 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.11 -19.66 14.14 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.306 -0.872 . . . . 0.0 110.232 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.501 ' C ' ' CD1' ' A' ' 124' ' ' PHE . 16.5 t80 -86.86 -49.14 7.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.215 -0.928 . . . . 0.0 109.074 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.3 mm -75.96 -25.7 17.2 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.788 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 1.003 ' NH2' ' HB2' ' A' ' 122' ' ' GLU . 1.8 ttm-85 -73.04 -54.64 8.05 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.159 -0.963 . . . . 0.0 109.007 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.8 t -63.81 -12.39 35.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.412 -0.805 . . . . 0.0 109.578 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -84.82 -38.11 19.93 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.19 -0.944 . . . . 0.0 109.601 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.494 ' CD2' ' NZ ' ' A' ' 75' ' ' LYS . 92.2 mt -72.57 -39.99 66.98 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.946 . . . . 0.0 109.315 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 1.017 ' CA ' ' HZ3' ' A' ' 130' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.094 -1.004 . . . . 0.0 109.512 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -134.06 118.27 17.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.385 -0.822 . . . . 0.0 109.176 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.89 140.41 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.869 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 2.6 t70 -97.07 45.48 1.04 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 108.959 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.446 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -40.46 -21.58 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.432 -0.793 . . . . 0.0 109.724 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.7 tt0 -52.88 -42.17 65.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.241 -0.912 . . . . 0.0 109.28 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.57 -67.04 0.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.192 -0.942 . . . . 0.0 109.419 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.66 ' SG ' ' CE2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -44.69 -60.59 1.93 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.206 -0.934 . . . . 0.0 109.701 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.568 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 11.3 ttp180 -44.22 -58.54 2.82 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.927 -1.108 . . . . 0.0 109.778 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.68 -28.94 16.27 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.062 -1.024 . . . . 0.0 109.229 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' CYS . . . -87.69 -50.92 6.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.198 -0.938 . . . . 0.0 109.776 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -45.74 -56.17 5.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.941 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.723 HD21 ' ND2' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -64.25 -40.1 95.31 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.11 -0.994 . . . . 0.0 109.411 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.6 -25.5 66.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.884 . . . . 0.0 109.275 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.431 ' CG2' ' O ' ' A' ' 13' ' ' ALA . 29.6 t -80.88 -13.9 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.245 -0.909 . . . . 0.0 109.377 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.241 179.878 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.21 0.528 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.552 ' O ' ' CG2' ' A' ' 24' ' ' VAL . 12.4 m -59.35 70.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.31 -0.869 . . . . 0.0 110.449 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.585 ' N ' ' O ' ' A' ' 23' ' ' ALA . 2.2 tt -45.69 -41.73 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.923 -1.11 . . . . 0.0 108.366 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.437 ' H ' HG23 ' A' ' 25' ' ' ILE . 33.2 p-90 -142.95 136.97 29.07 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.714 -1.241 . . . . 0.0 109.776 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -115.24 144.87 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.42 -0.8 . . . . 0.0 110.107 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.4 p -133.71 144.02 48.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.429 -0.795 . . . . 0.0 110.972 -179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.66 ' CE2' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -129.42 130.05 45.47 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 179.297 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -107.7 149.43 28.15 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.465 -0.772 . . . . 0.0 109.597 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.479 ' OH ' ' OG1' ' A' ' 94' ' ' THR . 6.0 m-85 -49.02 98.73 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.455 -0.778 . . . . 0.0 109.912 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.64 101.61 13.48 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.94 -119.07 16.59 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.08 22.83 15.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.394 -1.062 . . . . 0.0 110.015 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 m -145.7 129.35 17.1 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.19 -0.944 . . . . 0.0 109.765 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.577 ' CD1' ' N ' ' A' ' 36' ' ' ILE . 1.6 mp -78.54 113.84 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 108.947 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.424 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -135.58 153.7 77.77 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.285 -0.884 . . . . 0.0 109.822 -179.304 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.424 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.9 Cg_exo -32.02 145.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.357 0 C-N-CA 122.989 2.46 . . . . 0.0 112.26 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -139.1 -33.38 0.17 Allowed Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.542 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -143.28 -179.0 6.13 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 121.715 -0.873 . . . . 0.0 109.276 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.674 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -153.17 -171.53 3.95 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.797 0.808 . . . . 0.0 110.838 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -166.71 128.2 1.71 Allowed Glycine 0 N--CA 1.483 1.822 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.08 -10.04 17.43 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -155.35 172.05 18.85 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.467 ' OH ' ' O ' ' A' ' 120' ' ' LEU . 9.4 t80 -70.22 -45.83 65.75 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 120.895 -1.128 . . . . 0.0 109.332 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.458 ' N ' ' CD ' ' A' ' 46' ' ' GLN . 1.2 mp0 -46.94 -39.19 11.84 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.083 -1.011 . . . . 0.0 110.087 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.633 ' CE1' HE22 ' A' ' 41' ' ' GLN . 0.4 OUTLIER -53.18 -24.65 11.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.696 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.576 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -72.3 -25.77 61.71 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.175 -0.953 . . . . 0.0 109.074 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.411 HG12 ' CE2' ' A' ' 48' ' ' PHE . 7.4 mt -83.35 -15.81 11.41 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 O-C-N 121.104 -0.998 . . . . 0.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.514 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 13.6 tp60 -88.3 -53.18 4.82 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.986 -1.071 . . . . 0.0 110.665 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.614 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -102.79 55.87 0.77 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.509 -0.745 . . . . 0.0 111.681 -177.427 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.576 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 34.4 m -155.38 63.64 0.62 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.93 -1.106 . . . . 0.0 109.792 179.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.614 ' C ' ' H ' ' A' ' 55' ' ' ASP . 10.2 p -87.75 158.67 18.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.146 -0.971 . . . . 0.0 110.029 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -60.23 12.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.333 -0.854 . . . . 0.0 110.56 -179.69 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.614 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -111.23 27.79 9.35 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 109.878 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.536 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.0 OUTLIER -148.21 148.76 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.087 -1.008 . . . . 0.0 109.816 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -125.99 128.75 47.96 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.459 -0.776 . . . . 0.0 109.625 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.584 ' O ' ' N ' ' A' ' 81' ' ' TRP . 2.7 pp -172.64 -173.38 1.0 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.046 -1.034 . . . . 0.0 109.985 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.564 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 3.4 m-85 -114.68 159.18 20.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.354 -0.842 . . . . 0.0 108.812 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 79' ' ' ILE . . . -139.34 150.99 46.01 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.789 -1.194 . . . . 0.0 109.143 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.516 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 28.1 t80 -148.86 97.11 2.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.175 -0.953 . . . . 0.0 109.181 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -117.07 152.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.071 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.9 119.07 22.26 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.491 -0.756 . . . . 0.0 109.163 179.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -100.47 156.22 17.39 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 0.0 109.573 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.0 t -77.73 141.64 39.19 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.17 -0.956 . . . . 0.0 108.975 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.509 ' O ' ' NZ ' ' A' ' 130' ' ' LYS . 1.7 m . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.472 -0.767 . . . . 0.0 109.42 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.8 mmtt -104.63 158.09 16.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 109.813 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.49 ' O ' ' N ' ' A' ' 109' ' ' ALA . 65.7 m-85 -133.5 118.99 18.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.486 -0.759 . . . . 0.0 109.459 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.28 160.33 41.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.407 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.3 tt -105.99 157.13 17.73 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.462 ' N ' ' O ' ' A' ' 60' ' ' ALA . 2.8 mt -135.13 136.1 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.072 -1.017 . . . . 0.0 108.961 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -95.96 117.16 30.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.584 ' N ' ' O ' ' A' ' 58' ' ' LEU . 66.8 t-105 -95.22 111.25 23.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.869 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.415 ' O ' ' C ' ' A' ' 83' ' ' GLY . 4.4 mm -116.41 92.77 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.66 161.77 0.06 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -88.85 -27.49 21.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.344 -1.092 . . . . 0.0 109.565 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.9 47.59 0.87 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.323 -0.86 . . . . 0.0 109.664 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.23 166.26 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.286 -0.884 . . . . 0.0 109.733 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.533 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 11.2 t -87.11 -170.92 3.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.398 -0.814 . . . . 0.0 109.748 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.533 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.2 -16.64 66.56 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.418 ' CA ' ' HZ3' ' A' ' 93' ' ' LYS . 10.8 mt -45.93 -41.37 11.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.134 -1.215 . . . . 0.0 109.822 -179.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.579 ' H ' ' CD ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -68.76 -29.38 67.76 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.113 -0.992 . . . . 0.0 109.076 179.641 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.439 ' N ' ' O ' ' A' ' 88' ' ' GLY . 10.0 tmm_? -53.59 -60.78 2.87 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 110.206 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.62 -42.63 34.27 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.11 -0.994 . . . . 0.0 110.131 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.418 ' HZ3' ' CA ' ' A' ' 89' ' ' LEU . 54.8 mttp -61.96 -63.65 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.102 -0.999 . . . . 0.0 110.049 -179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.479 ' OG1' ' OH ' ' A' ' 31' ' ' TYR . 13.6 m -45.33 -51.56 10.92 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.152 -0.967 . . . . 0.0 109.806 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -43.19 -65.46 1.45 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -49.48 72.93 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.106 -1.232 . . . . 0.0 111.34 -178.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.557 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.1 OUTLIER -68.23 -39.75 82.22 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.87 -1.144 . . . . 0.0 111.593 -177.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -60.35 -23.95 64.67 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 120.732 -1.23 . . . . 0.0 109.251 -179.593 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.0 m -83.32 -20.52 34.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 108.694 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -79.56 -61.22 2.07 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.433 -0.792 . . . . 0.0 109.366 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.1 p -56.46 -28.37 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.244 -0.91 . . . . 0.0 109.971 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -71.55 -39.56 70.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.127 -0.983 . . . . 0.0 109.708 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.62 -31.4 69.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.111 -0.993 . . . . 0.0 110.097 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.6 t -97.14 36.92 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.544 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 8.4 p -119.53 66.02 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.272 -0.892 . . . . 0.0 109.404 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.15 42.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.204 -0.935 . . . . 0.0 109.802 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.723 ' ND2' HD21 ' A' ' 15' ' ' ASN . 4.3 m-20 -136.33 -31.04 0.9 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.553 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -72.78 -164.65 0.17 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.323 -0.861 . . . . 0.0 110.104 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -132.6 -27.58 1.71 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.504 -0.747 . . . . 0.0 109.091 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 21.3 tttp -162.2 150.63 14.87 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.304 -0.873 . . . . 0.0 109.404 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.81 149.23 25.83 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.241 -0.912 . . . . 0.0 109.278 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -135.74 153.98 51.39 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.343 -0.848 . . . . 0.0 109.966 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 5.8 p -120.9 137.7 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 4.4 mm -127.07 160.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.858 . . . . 0.0 110.433 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 14.3 t -140.63 5.64 2.01 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -146.06 155.3 42.69 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.37 -0.831 . . . . 0.0 109.392 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -75.99 -30.93 58.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.241 -0.912 . . . . 0.0 110.045 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -76.17 -7.73 55.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.145 -0.972 . . . . 0.0 109.368 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.907 ' OE1' ' CE1' ' A' ' 124' ' ' PHE . 2.4 mm-40 -86.58 3.87 42.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.205 -0.934 . . . . 0.0 109.785 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.467 ' O ' ' OH ' ' A' ' 45' ' ' TYR . 1.6 tp -98.91 -0.35 42.46 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.236 -0.915 . . . . 0.0 108.993 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.19 144.41 12.55 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.578 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.36 -48.58 80.62 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.244 -0.91 . . . . 0.0 109.78 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -56.23 -20.42 18.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.921 . . . . 0.0 109.679 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.907 ' CE1' ' OE1' ' A' ' 119' ' ' GLU . 78.3 t80 -86.67 -50.69 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.169 -0.957 . . . . 0.0 109.269 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -73.7 -25.62 20.89 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -69.47 -51.83 32.35 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.174 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.3 t -63.81 -17.95 63.62 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.275 -0.89 . . . . 0.0 109.325 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -73.06 -42.11 63.43 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.238 -0.914 . . . . 0.0 109.265 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 34.9 mt -73.19 -51.13 18.94 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.276 -0.89 . . . . 0.0 109.099 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.509 ' NZ ' ' O ' ' A' ' 66' ' ' THR . 6.0 mptp? . . . . . 0 N--CA 1.488 1.449 0 O-C-N 121.139 -0.976 . . . . 0.0 109.586 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.641 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.666 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.578 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.775 HD21 HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.541 ' O ' ' CG1' ' A' ' 17' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.448 ' C ' ' O ' ' A' ' 24' ' ' VAL . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.666 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.537 ' OH ' ' CG2' ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.429 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.544 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.464 ' CA ' ' CE2' ' A' ' 26' ' ' TRP . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.432 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.3 mm100 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 56' ' ' VAL . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.433 ' H ' ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.496 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.8 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.673 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.8 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.46 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.525 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.537 ' CG2' ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.409 ' OD2' ' CD1' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.439 ' CG2' ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.478 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.775 HD21 HD21 ' A' ' 15' ' ' ASN . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.59 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -140.95 118.24 11.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.302 -0.874 . . . . 0.0 109.344 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 1.609 HD12 ' CG1' ' A' ' 101' ' ' VAL . 15.0 tt -107.53 146.39 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.626 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.8 p30 -75.72 -51.99 11.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.083 -1.01 . . . . 0.0 110.829 -178.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' A' ' 6' ' ' ASP . 5.7 mttm 64.29 -43.06 0.28 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.296 -0.877 . . . . 0.0 109.797 -179.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.8 tm-20 -46.36 -38.83 9.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 109.843 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.9 -60.03 2.47 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.188 -0.945 . . . . 0.0 109.487 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -44.91 -69.65 0.13 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.377 -0.827 . . . . 0.0 110.159 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -45.45 -56.18 5.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.63 -43.96 69.14 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.189 -0.945 . . . . 0.0 110.253 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.01 -45.61 23.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.007 -1.058 . . . . 0.0 110.369 -179.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 3.0 m-30 -45.43 -55.2 6.37 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 110.249 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.71 HD21 ' ND2' ' A' ' 107' ' ' ASN . 0.3 OUTLIER -71.23 -21.64 62.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.062 -1.024 . . . . 0.0 109.803 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.7 tp -72.18 -41.2 67.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.215 -0.928 . . . . 0.0 109.872 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.82 -10.22 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 109.462 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.491 ' NH2' ' OD1' ' A' ' 15' ' ' ASN . 10.0 ttm180 . . . . . 0 N--CA 1.489 1.51 0 O-C-N 121.239 -0.913 . . . . 0.0 109.306 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.411 0.624 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.541 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.5 OUTLIER -70.06 128.66 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.415 -0.803 . . . . 0.0 109.907 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.438 HG21 HD11 ' A' ' 25' ' ' ILE . 12.3 tt -61.89 -34.26 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.108 -0.995 . . . . 0.0 108.757 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.604 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 32.1 p-90 -160.29 151.96 19.86 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.268 -0.895 . . . . 0.0 109.386 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.6 m -119.22 141.67 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.442 -0.786 . . . . 0.0 109.355 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -131.99 136.31 47.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.863 . . . . 0.0 109.547 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.496 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.36 163.86 15.72 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.452 ' O ' ' C ' ' A' ' 31' ' ' TYR . 10.6 ptm180 -140.81 147.76 39.54 Favored 'General case' 0 C--N 1.289 -2.029 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.443 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.661 ' OH ' ' OD1' ' A' ' 97' ' ' ASP . 3.9 m-85 -39.85 98.68 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.73 -0.607 . . . . 0.0 110.241 -178.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 1.184 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -96.86 101.42 13.0 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.554 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 51.5 -119.89 9.09 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 108.683 -1.767 . . . . 0.0 108.683 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.96 21.58 17.33 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.364 -1.08 . . . . 0.0 110.095 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 1.184 ' O ' ' OD1' ' A' ' 32' ' ' ASP . 1.4 m -142.3 133.1 25.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 109.781 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.447 ' CA ' ' OD1' ' A' ' 32' ' ' ASP . 1.6 mp -80.64 110.56 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.349 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.879 HG13 ' OD1' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -135.5 153.49 77.76 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.358 -0.839 . . . . 0.0 109.63 -179.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 37' ' ' VAL . 86.4 Cg_exo -33.84 146.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.993 2.462 . . . . 0.0 112.316 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.2 -26.36 0.15 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.545 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -142.89 -178.56 5.87 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.421 -1.046 . . . . 0.0 109.466 -179.475 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.768 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -160.44 177.64 10.36 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 121.746 0.784 . . . . 0.0 110.736 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -163.69 135.82 3.97 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -108.03 -5.44 17.06 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -159.02 175.4 13.58 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -11.24 60.0 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.17 -0.956 . . . . 0.0 109.527 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -78.14 -31.77 49.98 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.936 -1.103 . . . . 0.0 110.149 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -42.9 91.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.002 -1.061 . . . . 0.0 109.549 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.587 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -55.83 -31.22 62.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.342 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.42 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.3 mt -83.2 -13.96 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.016 -1.052 . . . . 0.0 109.999 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -87.18 -52.53 5.36 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.612 -1.305 . . . . 0.0 109.77 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.583 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -100.74 55.05 0.86 Allowed 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 110.896 -178.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.9 t -154.0 67.14 0.73 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.003 -1.06 . . . . 0.0 109.64 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.632 ' C ' ' H ' ' A' ' 55' ' ' ASP . 7.6 p -84.44 154.9 22.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.248 -0.907 . . . . 0.0 110.003 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER -58.05 8.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.478 -0.763 . . . . 0.0 110.482 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.632 ' H ' ' C ' ' A' ' 53' ' ' THR . 2.5 m-20 -109.95 26.78 10.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 0.0 109.366 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.555 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.8 OUTLIER -147.27 148.0 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 109.63 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.581 ' NH2' ' O ' ' A' ' 83' ' ' GLY . 3.2 ptp180 -130.47 133.61 46.43 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 110.329 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.498 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 4.0 pp -172.63 179.51 2.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.698 . . . . 0.0 109.279 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.509 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -113.77 154.24 27.71 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.044 -1.035 . . . . 0.0 109.162 179.814 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.39 159.14 42.85 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.015 -1.053 . . . . 0.0 109.294 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 15.0 t80 -148.5 107.56 3.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.641 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -121.48 153.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.339 -0.85 . . . . 0.0 109.641 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -87.08 108.39 18.86 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -90.2 155.5 18.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.278 -0.888 . . . . 0.0 109.927 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -80.74 140.04 35.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 108.809 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.141 -0.974 . . . . 0.0 109.547 -179.891 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -105.22 153.84 21.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 109.751 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.471 ' O ' ' N ' ' A' ' 109' ' ' ALA . 78.6 m-85 -126.88 120.47 29.3 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.492 -0.755 . . . . 0.0 109.371 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.18 160.4 41.5 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.003 . . . . 0.0 110.496 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.8 tt -108.78 158.0 18.05 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.4 mt -138.31 143.64 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 120.931 -1.105 . . . . 0.0 108.928 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.22 120.26 41.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.193 -0.942 . . . . 0.0 109.696 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . 0.555 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 61.1 t-105 -93.15 112.02 23.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.136 -0.977 . . . . 0.0 109.611 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.1 93.24 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 108.807 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.581 ' O ' ' NH2' ' A' ' 57' ' ' ARG . . . -64.67 160.4 41.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 54' ' ' ASP . 2.4 mm-40 -121.13 71.43 0.95 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.617 -0.931 . . . . 0.0 109.766 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.513 ' O ' ' O ' ' A' ' 86' ' ' VAL . 0.4 OUTLIER -178.12 -24.93 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.05 -1.031 . . . . 0.0 110.067 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.513 ' O ' ' O ' ' A' ' 85' ' ' ASP . 1.9 t -59.51 -134.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.064 -1.022 . . . . 0.0 109.787 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.7 m -125.93 -177.73 4.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.507 -0.746 . . . . 0.0 110.121 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.15 -18.04 63.65 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.903 -1.279 . . . . 0.0 109.903 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mp -47.69 -57.05 6.01 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.186 -1.184 . . . . 0.0 109.864 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.497 ' O ' ' N ' ' A' ' 94' ' ' THR . 1.0 OUTLIER -62.37 -31.38 72.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.192 -0.942 . . . . 0.0 109.729 -179.708 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 4.5 tpt180 -45.09 -65.79 0.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.753 -1.217 . . . . 0.0 110.042 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.61 -33.4 66.66 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.146 -0.971 . . . . 0.0 110.235 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.462 ' C ' ' OH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -69.47 -58.66 3.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.132 -0.98 . . . . 0.0 109.87 -179.59 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.497 ' N ' ' O ' ' A' ' 90' ' ' GLN . 3.5 m -44.64 -36.4 3.07 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.144 -0.972 . . . . 0.0 109.362 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -57.53 -57.1 21.55 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 m -66.45 -47.28 73.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.956 -1.32 . . . . 0.0 111.143 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.661 ' OD1' ' OH ' ' A' ' 31' ' ' TYR . 3.0 m-20 -69.17 -43.27 74.58 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.745 -1.222 . . . . 0.0 111.434 -177.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 99' ' ' THR . 0.0 OUTLIER -54.88 -26.11 33.48 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.68 -1.262 . . . . 0.0 108.702 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.405 ' N ' ' HG3' ' A' ' 98' ' ' LYS . 52.5 m -75.66 -29.85 59.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.318 -0.864 . . . . 0.0 108.917 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.7 -58.47 5.03 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 1.609 ' CG1' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -65.85 -25.92 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.122 -0.986 . . . . 0.0 110.441 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 19.4 tttp -70.68 -37.99 73.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.06 -1.025 . . . . 0.0 109.945 -179.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.469 ' C ' ' H ' ' A' ' 105' ' ' VAL . 27.6 tt0 -79.26 -37.35 38.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.528 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.458 ' O ' ' OE1' ' A' ' 106' ' ' GLN . 2.9 p -73.19 18.56 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.016 -1.053 . . . . 0.0 110.029 -179.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.469 ' H ' ' C ' ' A' ' 103' ' ' GLU . 4.5 p -98.31 133.5 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.107 -0.996 . . . . 0.0 109.635 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.49 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -138.8 31.15 2.26 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.382 -0.969 . . . . 0.0 108.382 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.71 ' ND2' HD21 ' A' ' 15' ' ' ASN . 17.4 m-20 -136.09 -22.95 1.35 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.611 -0.68 . . . . 0.0 110.118 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PHE . . . . . 0.572 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -81.92 168.35 18.0 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.957 -1.089 . . . . 0.0 110.281 -179.491 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -109.07 -29.33 8.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.566 -0.709 . . . . 0.0 109.166 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -162.28 151.74 15.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 109.404 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.97 154.28 20.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.324 -0.86 . . . . 0.0 109.244 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -136.46 159.13 42.71 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.268 -0.895 . . . . 0.0 109.9 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.6 p -121.67 144.23 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 4.7 mm -129.13 158.51 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.166 -0.959 . . . . 0.0 110.172 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 88.8 p -138.73 2.2 2.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -145.35 154.1 41.95 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.881 . . . . 0.0 109.446 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.9 ttp180 -73.56 -31.36 63.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.215 -0.928 . . . . 0.0 109.856 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.78 -6.99 54.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.129 -0.982 . . . . 0.0 109.483 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.599 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 4.4 mm-40 -86.45 3.54 43.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.103 -0.998 . . . . 0.0 109.778 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.4 mt -105.97 13.95 28.61 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 109.001 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -64.62 148.54 50.68 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.514 -0.741 . . . . 0.0 109.793 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.25 -51.78 68.49 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.187 -0.946 . . . . 0.0 109.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -55.25 -21.92 16.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 109.738 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 66.3 t80 -84.83 -49.07 8.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.88 . . . . 0.0 109.143 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -69.32 -12.45 16.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -82.37 -50.31 9.05 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.145 -0.972 . . . . 0.0 109.644 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -24.13 67.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.221 -0.925 . . . . 0.0 110.458 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 129' ' ' LEU . 15.3 pt-20 -85.3 -39.77 17.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.96 -1.088 . . . . 0.0 109.713 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.41 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 5.4 mt -75.3 -36.26 61.17 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.121 -0.987 . . . . 0.0 108.664 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.491 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.466 ' O ' ' N ' ' A' ' 3' ' ' THR . 41.1 mtt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.329 0.585 . . . . 0.0 109.505 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 67.16 -68.25 0.15 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.207 -0.933 . . . . 0.0 109.51 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.579 ' OG1' ' NZ ' ' A' ' 93' ' ' LYS . 19.7 m -158.96 146.06 17.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.919 . . . . 0.0 109.527 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.28 118.36 18.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.415 -0.803 . . . . 0.0 109.079 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -107.57 139.62 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.333 -0.854 . . . . 0.0 109.89 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.591 ' O ' ' N ' ' A' ' 8' ' ' GLU . 46.9 t0 -100.54 35.71 2.07 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.273 -0.892 . . . . 0.0 108.989 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.636 ' HZ1' ' CA ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -43.63 -16.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.933 . . . . 0.0 109.4 -179.62 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.636 ' CA ' ' HZ1' ' A' ' 7' ' ' LYS . 5.3 tt0 -54.11 -40.54 67.39 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.168 -0.957 . . . . 0.0 108.823 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -68.22 -63.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.384 -0.822 . . . . 0.0 108.804 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.658 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.2 m -44.65 -53.28 7.38 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.294 -0.879 . . . . 0.0 109.009 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 10' ' ' CYS . 20.6 ttt180 -43.55 -59.73 2.05 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.099 -1.0 . . . . 0.0 109.456 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.42 -40.79 2.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.389 -0.819 . . . . 0.0 109.556 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.533 ' O ' ' CG2' ' A' ' 17' ' ' VAL . . . -86.46 -35.9 19.38 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.088 -1.008 . . . . 0.0 110.018 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.731 ' HH ' ' H ' ' A' ' 107' ' ' ASN . 1.2 t80 -45.44 -67.95 0.24 Allowed 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.431 -0.793 . . . . 0.0 110.36 -179.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.643 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 0.4 OUTLIER -75.69 -32.74 60.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.356 -0.84 . . . . 0.0 110.746 -178.72 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.692 HD22 ' OG ' ' A' ' 22' ' ' SER . 12.6 tp -69.13 -27.89 65.97 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.749 -1.22 . . . . 0.0 109.146 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.533 ' CG2' ' O ' ' A' ' 13' ' ' ALA . 22.5 t -58.66 -1.65 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.587 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.9 OUTLIER -110.35 1.14 18.27 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.264 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.57 159.84 16.99 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.293 -0.88 . . . . 0.0 109.412 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -92.52 22.29 4.75 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.202 -0.936 . . . . 0.0 108.864 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.44 ' O ' ' C ' ' A' ' 22' ' ' SER . . . -109.66 -84.63 1.57 Allowed Glycine 0 N--CA 1.489 2.173 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.692 ' OG ' HD22 ' A' ' 16' ' ' LEU . 0.9 OUTLIER -41.02 -53.89 2.89 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.054 -1.262 . . . . 0.0 110.534 -178.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.592 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . 77.94 -15.37 0.76 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.239 -0.913 . . . . 0.0 109.799 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.407 ' O ' ' CG1' ' A' ' 24' ' ' VAL . 6.9 p -46.44 91.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.992 -1.067 . . . . 0.0 108.932 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.5 tt -43.98 -54.07 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 121.25 -0.906 . . . . 0.0 109.7 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.631 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 41.8 p-90 -143.99 166.71 24.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.505 -1.372 . . . . 0.0 111.498 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.1 m -136.34 138.84 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.602 -0.686 . . . . 0.0 109.4 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.8 p -125.87 141.14 52.13 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.308 -0.87 . . . . 0.0 110.173 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.658 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.21 160.89 25.6 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.65 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -137.87 146.69 43.69 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 121.243 -0.911 . . . . 0.0 109.59 -179.598 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.574 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 4.7 m-85 -59.75 98.5 0.05 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.462 -0.774 . . . . 0.0 110.019 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.574 ' N ' ' OD1' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -94.97 102.16 13.97 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.375 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.97 -119.84 7.0 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.2 26.89 10.1 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.325 -1.103 . . . . 0.0 110.615 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.3 m -145.57 151.17 37.7 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.854 -1.154 . . . . 0.0 110.686 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.473 ' CD1' ' N ' ' A' ' 36' ' ' ILE . 1.8 mp -101.55 107.22 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -135.7 151.81 74.95 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.292 -0.88 . . . . 0.0 110.018 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.2 Cg_exo -31.88 139.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 123.069 2.513 . . . . 0.0 112.391 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.12 -35.56 0.21 Allowed Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.578 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.7 m-20 -142.71 -179.02 6.07 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.806 -0.82 . . . . 0.0 108.878 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.778 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -159.25 -170.19 2.89 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.368 -0.832 . . . . 0.0 110.138 -179.778 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.18 140.62 6.31 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.42 -4.78 15.4 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.04 175.22 13.79 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.492 ' OH ' ' O ' ' A' ' 120' ' ' LEU . 1.3 t80 -72.18 -46.29 56.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 120.996 -1.065 . . . . 0.0 109.355 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 45' ' ' TYR . 14.6 mm-40 -42.22 -29.38 0.24 Allowed 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.294 -0.879 . . . . 0.0 110.077 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.709 ' CE1' HE22 ' A' ' 41' ' ' GLN . 2.7 t-160 -66.62 -47.91 71.14 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.073 -1.017 . . . . 0.0 109.135 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -42.97 -28.0 0.23 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.478 ' C ' ' H ' ' A' ' 51' ' ' GLN . 1.9 mt -75.39 -45.56 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.371 -0.83 . . . . 0.0 110.605 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -81.4 8.34 9.55 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 179.064 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.578 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -119.82 -22.3 6.86 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.257 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.449 ' O ' ' CG2' ' A' ' 53' ' ' THR . 0.1 OUTLIER -69.35 141.08 54.29 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.206 -0.934 . . . . 0.0 109.298 179.73 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.458 ' C ' ' H ' ' A' ' 55' ' ' ASP . 33.0 p -157.43 114.19 2.97 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.594 -0.842 . . . . 0.0 110.741 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.569 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.5 OUTLIER -64.11 -0.53 1.21 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.458 ' H ' ' C ' ' A' ' 53' ' ' THR . 10.1 m-20 -110.12 19.12 19.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.448 -0.783 . . . . 0.0 109.373 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' OG1' ' A' ' 53' ' ' THR . 0.3 OUTLIER -144.13 166.18 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.0 110.158 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.704 HH12 ' N ' ' A' ' 91' ' ' ARG . 8.4 ptp180 -136.92 136.43 38.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.803 -0.759 . . . . 0.0 109.885 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.473 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.8 pp -172.31 166.59 5.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.395 -0.816 . . . . 0.0 109.692 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -100.01 156.9 16.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.056 -1.028 . . . . 0.0 108.801 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.434 ' N ' ' O ' ' A' ' 79' ' ' ILE . . . -127.64 152.62 47.45 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.187 -0.946 . . . . 0.0 108.99 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.576 ' CZ ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -146.19 96.11 2.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.283 -0.886 . . . . 0.0 109.254 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -121.3 151.64 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.074 -1.016 . . . . 0.0 109.76 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 1.066 ' CZ ' ' HG ' ' A' ' 74' ' ' SER . 12.5 ttp180 -92.68 117.57 30.13 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -99.44 155.71 17.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.178 -0.951 . . . . 0.0 110.142 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 m -77.77 146.57 35.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.42 -0.8 . . . . 0.0 108.975 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.7 m -109.74 -27.34 9.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.49 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 49.44 46.39 36.59 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -171.94 -78.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.202 -1.175 . . . . 0.0 109.537 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.558 ' C ' ' H ' ' A' ' 71' ' ' SER . . . -56.58 100.55 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.189 -0.945 . . . . 0.0 109.468 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.0 ptt? -54.63 -5.02 0.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.273 -0.892 . . . . 0.0 109.504 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.56 ' C ' ' H ' ' A' ' 73' ' ' ARG . 37.1 m -60.08 103.42 0.22 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.287 -0.883 . . . . 0.0 109.511 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER 53.78 4.94 0.05 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.273 -0.892 . . . . 0.0 109.449 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.56 ' H ' ' C ' ' A' ' 71' ' ' SER . 17.9 mtp180 42.92 70.26 0.31 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.281 -0.887 . . . . 0.0 109.485 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 1.066 ' HG ' ' CZ ' ' A' ' 63' ' ' ARG . 1.2 m 164.23 144.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.251 -0.906 . . . . 0.0 109.525 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tptp -105.3 161.84 13.94 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.353 -0.842 . . . . 0.0 109.711 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -133.09 124.46 27.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.429 -0.794 . . . . 0.0 109.449 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.92 159.39 43.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.839 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.768 ' C ' HD12 ' A' ' 79' ' ' ILE . 8.6 tp -111.25 150.04 30.16 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.768 HD12 ' C ' ' A' ' 78' ' ' LEU . 1.5 mp -128.97 144.03 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.998 -1.064 . . . . 0.0 109.329 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.7 m -105.19 137.25 43.27 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.877 . . . . 0.0 109.944 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.2 t-105 -114.76 110.62 19.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.392 -0.817 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -105.95 93.49 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.16 -0.962 . . . . 0.0 109.119 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.93 155.73 29.84 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 54' ' ' ASP . 5.6 tp10 -105.92 42.9 1.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.458 -1.025 . . . . 0.0 109.521 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -161.84 19.17 0.11 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.167 -0.958 . . . . 0.0 109.613 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -92.41 164.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.089 -1.007 . . . . 0.0 109.63 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.431 ' H ' ' HG ' ' A' ' 87' ' ' SER . 1.7 p -67.7 169.92 8.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.43 -0.794 . . . . 0.0 109.703 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.28 -16.65 66.35 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.3 mt -61.4 -70.24 0.2 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 110.347 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.41 ' HB2' HH11 ' A' ' 57' ' ' ARG . 1.4 mt-30 -52.4 -26.99 14.0 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.366 -0.834 . . . . 0.0 109.924 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.704 ' N ' HH12 ' A' ' 57' ' ' ARG . 0.5 OUTLIER -52.39 -59.5 4.35 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.046 . . . . 0.0 109.744 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.46 -23.31 66.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 109.823 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.579 ' NZ ' ' OG1' ' A' ' 3' ' ' THR . 4.0 tptp -74.91 -48.47 24.54 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.132 -0.98 . . . . 0.0 109.228 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.574 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 13.2 m -46.01 -45.93 16.18 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.218 -0.926 . . . . 0.0 109.27 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -54.53 -58.54 12.79 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.129 -1.188 . . . . 0.0 110.129 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 88.2 m -64.76 -47.31 78.64 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.037 -1.272 . . . . 0.0 111.132 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -71.95 -43.63 64.89 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.771 -1.205 . . . . 0.0 111.612 -177.574 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -54.58 -26.19 30.85 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.668 -1.27 . . . . 0.0 109.127 -179.433 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -27.36 41.54 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -0.879 . . . . 0.0 108.639 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mt -68.82 -59.22 3.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.508 -0.745 . . . . 0.0 109.607 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.0 p -62.46 -29.33 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.183 -0.948 . . . . 0.0 110.037 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -66.53 -38.16 86.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.152 -0.968 . . . . 0.0 109.663 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -67.42 -24.19 65.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.23 -0.919 . . . . 0.0 109.617 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 20.4 t -86.79 30.27 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.224 -0.922 . . . . 0.0 109.667 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.475 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 2.7 p -95.17 126.5 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.138 -0.977 . . . . 0.0 109.765 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.455 ' C ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -151.7 22.84 0.69 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.323 -0.861 . . . . 0.0 109.943 -179.848 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.731 ' H ' ' HH ' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -148.46 39.92 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.997 -1.064 . . . . 0.0 110.026 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.539 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -149.15 -165.71 2.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.925 -1.11 . . . . 0.0 110.596 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.426 ' N ' ' CG ' ' A' ' 108' ' ' PHE . . . -118.14 -50.55 2.46 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.747 -0.595 . . . . 0.0 109.773 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.62 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -158.7 157.1 31.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.101 -0.999 . . . . 0.0 109.952 -179.722 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.588 ' OE1' ' N ' ' A' ' 112' ' ' PHE . 0.0 OUTLIER -104.87 159.79 15.52 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.465 -0.772 . . . . 0.0 108.968 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.588 ' N ' ' OE1' ' A' ' 111' ' ' GLU . 23.6 m-85 -136.15 161.72 34.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.183 -0.948 . . . . 0.0 109.772 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 80.6 t -121.36 150.38 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.488 ' CG2' ' N ' ' A' ' 115' ' ' SER . 56.3 mt -138.65 161.06 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 110.182 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.488 ' N ' ' CG2' ' A' ' 114' ' ' ILE . 0.3 OUTLIER -141.18 6.3 1.94 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.347 -0.845 . . . . 0.0 109.311 179.449 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -150.95 155.41 39.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.035 -1.04 . . . . 0.0 109.924 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -70.53 -31.96 69.24 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.262 -0.899 . . . . 0.0 109.599 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -67.77 -16.67 64.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.152 -0.967 . . . . 0.0 108.99 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.594 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.0 OUTLIER -86.54 1.64 50.9 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.339 -0.851 . . . . 0.0 109.763 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.492 ' O ' ' OH ' ' A' ' 45' ' ' TYR . 6.5 mt -97.49 20.17 12.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.199 -0.938 . . . . 0.0 108.87 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -74.84 152.72 38.92 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.552 -0.718 . . . . 0.0 109.883 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.98 -48.65 57.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 109.844 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -12.32 7.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.063 -1.023 . . . . 0.0 109.744 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.594 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 9.4 t80 -86.58 -49.07 7.81 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.938 0.875 . . . . 0.0 109.371 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 3.4 mt -74.8 -26.35 19.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.729 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.583 ' CD ' ' HZ2' ' A' ' 130' ' ' LYS . 29.9 ttt180 -68.59 -54.57 15.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.9 t -63.77 -15.8 59.57 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.345 -0.847 . . . . 0.0 109.663 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.545 ' CD ' ' CD1' ' A' ' 112' ' ' PHE . 2.2 tt0 -76.6 -39.99 50.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 109.246 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 12.8 mt -73.34 -48.06 37.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.229 -0.919 . . . . 0.0 109.244 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.583 ' HZ2' ' CD ' ' A' ' 126' ' ' ARG . 13.7 mttt -49.38 -24.15 1.8 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.116 -0.99 . . . . 0.0 109.376 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 132' ' ' ALA . 1.1 mtmm -72.1 -70.5 0.33 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.208 -0.932 . . . . 0.0 109.33 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 131' ' ' LYS . . . 42.48 62.72 1.62 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.262 -0.899 . . . . 0.0 109.49 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 134' ' ' GLY . . . -163.49 56.39 0.28 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 133' ' ' GLY . . . -43.02 123.07 3.75 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 137' ' ' TYR . . . -137.08 10.86 3.06 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.333 -1.098 . . . . 0.0 109.487 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.24 0.56 0.42 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 109.392 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.51 ' H ' ' C ' ' A' ' 135' ' ' ALA . 1.8 t80 -48.35 -41.03 27.38 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.203 -0.936 . . . . 0.0 109.495 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.44 1.59 11.45 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.289 -0.882 . . . . 0.0 109.492 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -94.81 9.86 37.48 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.241 -0.912 . . . . 0.0 109.472 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 51.88 37.96 22.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.288 -0.883 . . . . 0.0 109.471 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.36 -177.71 0.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.235 -0.915 . . . . 0.0 109.465 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.02 -0.991 . . . . 0.0 109.468 -179.931 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.459 ' O ' ' O ' ' A' ' 2' ' ' ALA . 32.1 mtt . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 1' ' ' MET . . . 60.74 144.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 109.486 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.551 ' OG1' ' NZ ' ' A' ' 93' ' ' LYS . 2.7 m -138.75 147.15 42.3 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.299 -0.875 . . . . 0.0 109.471 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -135.26 118.32 16.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.353 -0.842 . . . . 0.0 109.403 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -107.76 141.23 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.398 -0.814 . . . . 0.0 109.733 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -100.69 70.11 1.41 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.528 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.691 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -58.98 -24.49 62.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.243 -0.911 . . . . 0.0 109.494 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -46.06 68.14 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.449 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -67.47 0.44 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.549 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.82 -63.0 1.01 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.935 . . . . 0.0 109.845 -179.665 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 10.5 ttp180 -44.59 -56.26 4.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.909 -1.12 . . . . 0.0 109.678 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.44 -54.8 27.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.188 -0.945 . . . . 0.0 109.908 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.65 -43.72 83.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.134 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.54 ' CZ ' ' CB ' ' A' ' 61' ' ' PHE . 3.2 m-85 -46.8 -55.24 8.24 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.336 -0.852 . . . . 0.0 110.312 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.698 HD21 ' ND2' ' A' ' 107' ' ' ASN . 0.4 OUTLIER -78.94 -28.42 43.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.243 -0.911 . . . . 0.0 110.697 -178.703 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.7 tp -56.49 -19.29 14.68 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.792 -1.192 . . . . 0.0 109.473 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.422 ' C ' ' H ' ' A' ' 19' ' ' ASP . 1.5 m -77.58 -2.84 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.226 -0.921 . . . . 0.0 109.415 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.709 HH12 ' NH1' ' A' ' 73' ' ' ARG . 11.1 mtm180 -77.83 15.39 0.87 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.422 ' H ' ' C ' ' A' ' 17' ' ' VAL . 8.1 t0 -93.94 -156.97 0.52 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.89 . . . . 0.0 109.593 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -101.76 49.07 0.87 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.199 -0.938 . . . . 0.0 109.496 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.37 57.63 5.48 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -130.39 7.21 4.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.474 -1.015 . . . . 0.0 109.521 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.0 -162.12 1.15 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.39 -0.819 . . . . 0.0 109.919 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.429 ' O ' ' CG2' ' A' ' 24' ' ' VAL . 13.9 m -78.4 122.88 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.437 -0.789 . . . . 0.0 109.649 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.454 HG23 ' N ' ' A' ' 26' ' ' TRP . 14.0 tt -49.96 -34.27 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 120.894 -1.129 . . . . 0.0 108.4 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.568 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 37.0 p-90 -160.95 171.57 18.46 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.259 -0.9 . . . . 0.0 109.402 177.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.7 m -137.0 143.59 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.249 -0.907 . . . . 0.0 109.287 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.0 p -132.47 134.71 45.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.293 -0.879 . . . . 0.0 109.701 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.421 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -123.61 153.97 39.95 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.944 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.71 150.18 52.24 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.521 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.589 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 1.8 m-85 -55.04 99.28 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.569 -0.707 . . . . 0.0 110.443 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.87 101.08 13.16 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 65.49 -117.32 9.89 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.8 25.64 11.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -1.112 . . . . 0.0 110.113 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -145.42 150.16 36.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.73 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mt -104.15 108.44 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.334 -0.854 . . . . 0.0 108.989 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.9 m -135.49 158.76 73.74 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.254 -0.904 . . . . 0.0 109.724 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 87.6 Cg_exo -30.08 142.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 123.493 2.795 . . . . 0.0 112.689 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -140.55 -30.67 0.17 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.462 ' OD1' ' OE1' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -142.5 -178.9 5.99 Favored 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.625 -0.926 . . . . 0.0 109.263 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.77 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -162.69 175.68 11.1 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.871 -178.678 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.14 137.26 4.65 Favored Glycine 0 N--CA 1.486 1.977 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.78 -3.42 20.45 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.0 177.54 10.25 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.37 -10.58 59.54 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 120.883 -1.135 . . . . 0.0 109.218 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.491 ' N ' HE21 ' A' ' 46' ' ' GLN . 7.3 mm-40 -74.99 -36.68 61.99 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.049 -1.032 . . . . 0.0 110.255 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.546 ' O ' ' N ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -62.89 -53.3 56.32 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.966 -1.084 . . . . 0.0 109.569 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.572 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -45.45 -28.02 0.82 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.188 -0.945 . . . . 0.0 108.72 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.428 HG12 ' CE2' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -83.93 -17.01 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.272 -0.892 . . . . 0.0 110.134 179.405 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' A' ' 47' ' ' HIS . 5.3 tt0 -81.73 -54.45 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.775 -1.203 . . . . 0.0 109.176 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.593 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -72.47 -12.13 60.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.795 . . . . 0.0 109.736 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.411 ' C ' ' O ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -42.94 126.28 3.78 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.279 -0.888 . . . . 0.0 109.637 -179.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.571 ' C ' ' H ' ' A' ' 55' ' ' ASP . 5.6 p -150.62 110.49 4.08 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.873 0.844 . . . . 0.0 110.608 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -57.38 0.35 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.786 -0.571 . . . . 0.0 110.039 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.571 ' H ' ' C ' ' A' ' 53' ' ' THR . 50.7 t0 -109.05 31.86 5.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 109.56 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.37 168.31 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.022 -1.049 . . . . 0.0 110.477 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.632 HH12 ' N ' ' A' ' 91' ' ' ARG . 5.4 ptp180 -141.95 134.91 28.81 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.274 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.506 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 4.1 pp -172.71 168.94 5.08 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.334 -0.854 . . . . 0.0 109.621 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -108.71 160.56 15.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.128 -0.982 . . . . 0.0 109.003 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.47 157.37 45.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.93 -1.106 . . . . 0.0 109.365 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.54 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 37.1 t80 -148.48 104.2 3.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.278 -0.889 . . . . 0.0 109.221 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -120.07 153.38 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.356 -0.84 . . . . 0.0 109.447 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.495 ' NE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ttp180 -88.36 108.58 19.42 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.476 -0.765 . . . . 0.0 109.049 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -89.24 155.69 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.339 -0.85 . . . . 0.0 109.794 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.9 t -86.16 128.35 34.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.259 -0.901 . . . . 0.0 108.882 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.433 ' C ' ' H ' ' A' ' 68' ' ' ASP . 9.4 m -133.61 135.02 43.95 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.556 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.21 -40.62 1.5 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.517 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 0.3 OUTLIER 58.22 9.3 0.96 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.235 -1.156 . . . . 0.0 109.487 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.541 ' C ' ' H ' ' A' ' 71' ' ' SER . . . -102.73 150.32 23.58 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.296 -0.877 . . . . 0.0 109.482 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 7.4 mtt -71.66 36.35 0.06 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.182 -0.949 . . . . 0.0 109.496 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.541 ' H ' ' C ' ' A' ' 69' ' ' ALA . 69.8 m -101.17 -48.81 4.28 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.873 . . . . 0.0 109.428 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -100.79 -127.69 0.2 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 0.0 109.481 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.709 ' NH1' HH12 ' A' ' 18' ' ' ARG . 0.3 OUTLIER -173.58 69.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.495 ' CB ' ' NE ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER 56.93 160.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.304 -0.873 . . . . 0.0 109.391 -179.946 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.7 tptt -104.83 154.81 19.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.564 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -127.58 122.28 32.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.434 -0.791 . . . . 0.0 109.651 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.62 167.27 22.94 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.64 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.966 ' O ' HD12 ' A' ' 79' ' ' ILE . 5.5 tt -122.6 157.98 30.96 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.966 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.3 mp -136.09 149.62 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.96 -1.088 . . . . 0.0 108.626 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.498 ' CG2' ' HZ2' ' A' ' 98' ' ' LYS . 55.7 m -112.66 120.09 40.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.515 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -95.18 111.87 23.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.124 -0.985 . . . . 0.0 109.853 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.0 mm -108.9 93.2 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 108.673 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.32 153.76 35.05 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -104.03 43.24 1.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.481 -1.011 . . . . 0.0 109.713 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.87 11.82 0.49 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.128 -0.982 . . . . 0.0 109.743 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.9 t -89.16 160.19 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.122 -0.986 . . . . 0.0 109.668 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -176.96 0.81 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.433 -0.792 . . . . 0.0 109.796 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.21 -16.53 66.79 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.83 -70.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.167 -1.196 . . . . 0.0 110.239 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.589 ' CB ' HH11 ' A' ' 57' ' ' ARG . 76.9 mm-40 -60.04 -18.83 49.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.197 -0.94 . . . . 0.0 110.181 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.637 HH11 ' CG ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -55.25 -58.36 8.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.797 -1.189 . . . . 0.0 109.604 -179.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.89 -25.2 32.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.203 -0.936 . . . . 0.0 109.747 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.551 ' NZ ' ' OG1' ' A' ' 3' ' ' THR . 0.1 OUTLIER -72.11 -27.13 62.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 109.075 179.64 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.589 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 2.2 m -76.81 -52.1 10.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.396 -0.815 . . . . 0.0 109.106 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.451 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -41.77 -51.86 4.79 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.62 -56.53 9.04 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -1.15 . . . . 0.0 110.125 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -44.82 -37.95 4.19 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.13 -0.982 . . . . 0.0 110.52 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.498 ' HZ2' ' CG2' ' A' ' 80' ' ' THR . 0.2 OUTLIER -59.39 -43.36 92.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.775 -1.203 . . . . 0.0 108.193 179.357 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.4 m -46.83 -35.03 5.86 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.108 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.5 mt -71.18 -57.66 4.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.621 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 p -67.9 -13.68 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.169 -0.957 . . . . 0.0 110.052 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -81.85 -42.51 19.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.0 110.363 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.66 -25.41 30.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.035 -1.041 . . . . 0.0 110.952 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.432 ' O ' ' C ' ' A' ' 105' ' ' VAL . 3.2 p -81.03 -34.09 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 120.805 -1.185 . . . . 0.0 110.169 -179.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.432 ' C ' ' O ' ' A' ' 104' ' ' VAL . 7.5 p -42.99 134.09 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.031 -1.043 . . . . 0.0 109.621 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.492 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 4.9 pt20 -141.03 26.6 2.02 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.698 ' ND2' HD21 ' A' ' 15' ' ' ASN . 96.3 m-20 -144.51 39.72 1.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.498 -0.751 . . . . 0.0 109.603 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -142.0 149.09 39.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.0 . . . . 0.0 109.766 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -87.19 -33.5 19.34 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.643 ' NZ ' ' CZ ' ' A' ' 112' ' ' PHE . 0.7 OUTLIER -162.32 155.66 20.49 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.279 -0.888 . . . . 0.0 109.353 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 102' ' ' LYS . 6.8 pt-20 -104.45 156.36 18.0 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.319 -0.863 . . . . 0.0 109.171 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.643 ' CZ ' ' NZ ' ' A' ' 110' ' ' LYS . 24.1 m-85 -139.67 157.39 45.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.207 -0.933 . . . . 0.0 109.895 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -119.99 109.22 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.559 -0.713 . . . . 0.0 109.305 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 35.3 mm -98.73 152.02 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.444 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.8 t -139.39 7.23 2.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.265 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.0 155.26 45.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.511 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -70.21 -34.92 73.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.969 . . . . 0.0 109.613 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.673 ' HE2' ' OE2' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -75.28 -16.29 60.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 0.0 109.103 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.58 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.7 mp0 -86.4 -4.85 59.24 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.35 -0.844 . . . . 0.0 109.513 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.65 8.74 44.12 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.255 -0.903 . . . . 0.0 108.965 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.673 ' OE2' ' HE2' ' A' ' 118' ' ' LYS . 63.7 mt-10 -63.68 139.05 58.73 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 0.0 109.505 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.744 ' OE1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -52.23 -50.62 61.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . 0.744 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.4 OUTLIER -59.05 -42.47 90.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.895 -1.128 . . . . 0.0 109.687 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.58 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 63.7 t80 -55.48 -44.73 76.78 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.009 0.909 . . . . 0.0 109.064 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -74.47 -25.23 19.21 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -67.49 -52.64 36.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.242 -0.911 . . . . 0.0 109.188 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -20.11 65.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.242 -0.911 . . . . 0.0 109.234 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -71.65 -42.54 67.41 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.307 -0.871 . . . . 0.0 109.271 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.7 mt -73.88 -51.64 15.55 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 109.042 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -49.63 -23.44 1.7 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.209 -0.932 . . . . 0.0 109.287 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.41 -59.17 3.17 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.238 -0.914 . . . . 0.0 109.376 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 50.64 69.11 0.67 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.309 -0.87 . . . . 0.0 109.474 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.561 ' C ' ' H ' ' A' ' 135' ' ' ALA . . . -167.64 76.74 0.12 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -61.91 3.74 0.64 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.568 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . 55.43 45.01 26.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.161 -1.2 . . . . 0.0 109.437 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.702 HD21 ' N ' ' A' ' 137' ' ' TYR . 0.4 OUTLIER -46.51 -12.54 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.259 -0.901 . . . . 0.0 109.472 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.702 ' N ' HD21 ' A' ' 136' ' ' ASN . 0.2 OUTLIER -58.26 -15.5 10.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.232 -0.917 . . . . 0.0 109.451 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -93.36 -48.61 6.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.326 -0.859 . . . . 0.0 109.472 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 47.32 85.64 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.226 -0.921 . . . . 0.0 109.475 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 -78.33 9.76 3.61 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.311 -0.868 . . . . 0.0 109.519 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.73 7.68 35.6 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.248 -0.907 . . . . 0.0 109.537 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 118.022 -0.99 . . . . 0.0 109.413 179.961 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mmm . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' A' ' 3' ' ' THR . . . -149.36 122.09 8.66 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.52 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.475 ' O ' ' O ' ' A' ' 2' ' ' ALA . 7.2 m 59.35 147.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.292 -0.88 . . . . 0.0 109.475 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.4 mttp -123.67 129.06 50.54 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 109.532 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.8 tp -107.66 125.37 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.478 -0.764 . . . . 0.0 109.315 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.4 m-20 -97.61 43.39 1.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.208 -0.932 . . . . 0.0 109.293 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -42.32 -18.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 109.53 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 6' ' ' ASP . 34.4 mt-10 -55.89 -49.41 73.5 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 108.981 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -61.64 -66.58 0.51 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.353 -0.842 . . . . 0.0 108.939 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.6 m -44.83 -59.08 2.71 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.286 -0.884 . . . . 0.0 109.17 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.411 ' O ' ' C ' ' A' ' 12' ' ' ALA . 39.0 ttp180 -44.29 -56.06 4.45 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.034 -1.041 . . . . 0.0 109.744 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.74 -50.94 5.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.349 -0.845 . . . . 0.0 109.818 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' CG2' ' A' ' 17' ' ' VAL . . . -82.93 -35.07 26.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.377 -0.827 . . . . 0.0 110.262 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.704 ' CZ ' ' CE1' ' A' ' 61' ' ' PHE . 3.1 t80 -45.55 -65.79 0.49 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.367 -0.833 . . . . 0.0 110.302 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.69 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 3.5 m-80 -70.7 -44.55 66.71 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.326 -0.859 . . . . 0.0 110.756 -178.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.653 ' C ' ' H ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -51.75 -40.82 60.94 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.928 -1.107 . . . . 0.0 109.396 -179.158 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.441 ' CG2' ' O ' ' A' ' 13' ' ' ALA . 98.3 t -51.31 -2.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 120.934 -1.103 . . . . 0.0 109.735 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.653 ' H ' ' C ' ' A' ' 16' ' ' LEU . 1.6 ttp180 -105.68 -0.61 25.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.114 -0.991 . . . . 0.0 109.127 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -84.71 153.5 23.04 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.245 -0.909 . . . . 0.0 109.724 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -64.03 -13.32 45.94 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.354 -0.841 . . . . 0.0 110.036 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.52 ' O ' ' OG ' ' A' ' 22' ' ' SER . . . -97.13 -80.96 1.56 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.578 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 99.0 p 52.99 -130.8 2.2 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.544 -0.974 . . . . 0.0 110.455 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.578 ' CB ' ' O ' ' A' ' 22' ' ' SER . . . 146.32 -45.76 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.819 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.497 ' O ' ' CG1' ' A' ' 24' ' ' VAL . 13.0 p -85.53 109.97 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.453 HG23 ' N ' ' A' ' 26' ' ' TRP . 14.0 tt -56.86 -32.89 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.121 -0.987 . . . . 0.0 108.822 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.617 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 32.0 p-90 -160.7 149.67 16.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.229 -0.919 . . . . 0.0 109.876 178.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.1 m -117.55 134.73 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.487 -0.758 . . . . 0.0 109.263 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.404 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 40.8 p -124.9 143.63 50.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.362 -0.836 . . . . 0.0 109.901 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.654 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -121.74 163.6 18.81 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -140.89 146.67 37.77 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.359 -0.838 . . . . 0.0 109.835 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.588 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 3.3 m-85 -58.99 98.71 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.417 -0.802 . . . . 0.0 110.092 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.488 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.1 OUTLIER -100.02 101.19 12.2 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.424 ' O ' ' NZ ' ' A' ' 93' ' ' LYS . . . 73.08 -122.18 7.96 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.13 22.72 15.51 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.352 -1.087 . . . . 0.0 110.352 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.488 ' O ' ' OD1' ' A' ' 32' ' ' ASP . 4.0 m -138.39 153.88 48.92 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.081 -1.012 . . . . 0.0 110.197 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 1.7 mp -109.79 103.77 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.411 -0.806 . . . . 0.0 109.139 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.2 m -135.83 154.95 78.21 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.164 -0.96 . . . . 0.0 109.771 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.401 ' C ' ' O ' ' A' ' 37' ' ' VAL . 88.1 Cg_exo -32.27 140.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 123.231 2.621 . . . . 0.0 112.546 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -141.88 -21.51 0.25 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.551 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.18 -178.89 6.07 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.389 -1.065 . . . . 0.0 109.622 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.624 ' NE2' ' O ' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -157.74 179.81 8.86 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.627 0.727 . . . . 0.0 110.761 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.413 ' HA3' ' CE2' ' A' ' 26' ' ' TRP . . . -163.49 133.64 3.12 Favored Glycine 0 N--CA 1.485 1.951 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.456 ' O ' ' OD1' ' A' ' 44' ' ' ASP . . . -106.5 -8.56 17.01 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' A' ' 43' ' ' ALA . 59.5 m-20 -157.57 175.38 14.01 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.09 -41.37 67.39 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.806 -1.184 . . . . 0.0 109.267 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -51.58 -32.81 29.92 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.115 -0.991 . . . . 0.0 110.288 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.579 ' CE1' HE22 ' A' ' 41' ' ' GLN . 0.7 OUTLIER -65.37 -15.42 62.55 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.93 -1.106 . . . . 0.0 109.955 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -82.09 -27.65 32.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.941 -1.099 . . . . 0.0 108.774 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.411 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.9 mt -79.97 -19.36 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.251 -0.906 . . . . 0.0 110.91 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.546 ' NE2' ' C ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -87.02 -45.92 10.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.391 -1.443 . . . . 0.0 109.967 -179.684 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.601 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -105.32 56.66 0.68 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.261 -0.899 . . . . 0.0 110.884 -178.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 t -158.5 65.73 0.44 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.023 . . . . 0.0 109.501 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.586 ' C ' ' H ' ' A' ' 55' ' ' ASP . 20.6 p -85.19 150.62 24.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -0.924 . . . . 0.0 109.915 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.495 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 2.5 p30 -51.58 -4.05 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.453 -0.779 . . . . 0.0 109.99 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.586 ' H ' ' C ' ' A' ' 53' ' ' THR . 1.1 t0 -94.64 20.71 8.19 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.03 -1.044 . . . . 0.0 109.307 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.426 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -138.72 151.2 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 0.0 109.654 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.639 ' H ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -130.98 131.54 44.45 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.485 -0.76 . . . . 0.0 109.801 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.506 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 4.1 pp -172.66 175.52 3.43 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.995 -1.066 . . . . 0.0 110.504 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -111.24 152.68 26.87 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.57 156.99 45.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.956 -1.09 . . . . 0.0 109.628 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.704 ' CE1' ' CZ ' ' A' ' 14' ' ' TYR . 64.5 t80 -149.46 97.02 2.58 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.217 -0.927 . . . . 0.0 109.361 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.01 156.53 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.307 -0.871 . . . . 0.0 109.467 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -79.66 113.06 17.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.427 -0.796 . . . . 0.0 109.01 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -92.59 154.65 18.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.256 -0.902 . . . . 0.0 109.72 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.2 t -78.26 163.4 25.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 108.975 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.405 ' HA ' ' HZ3' ' A' ' 130' ' ' LYS . 0.3 OUTLIER -148.9 -36.76 0.18 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.258 -0.901 . . . . 0.0 109.518 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -86.42 -97.05 0.81 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.535 ' C ' ' H ' ' A' ' 70' ' ' MET . 5.3 p-10 -137.19 42.96 2.37 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -1.155 . . . . 0.0 109.541 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.488 ' CB ' ' O ' ' A' ' 68' ' ' ASP . . . 73.61 -26.85 0.19 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.24 -0.913 . . . . 0.0 109.483 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.535 ' H ' ' C ' ' A' ' 68' ' ' ASP . 0.4 OUTLIER -61.75 132.51 53.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.273 -0.892 . . . . 0.0 109.431 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.2 p -68.9 83.47 0.31 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.212 -0.93 . . . . 0.0 109.44 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -136.22 0.86 2.62 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.202 -0.936 . . . . 0.0 109.485 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -173.91 -68.09 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.238 -0.914 . . . . 0.0 109.484 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 62.26 149.6 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.199 -0.938 . . . . 0.0 109.416 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.409 ' HG3' ' H ' ' A' ' 76' ' ' PHE . 6.9 ttmt -107.91 165.34 11.53 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.327 -0.858 . . . . 0.0 109.313 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.69 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 2.0 m-85 -133.25 128.65 36.32 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 109.813 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.78 167.06 23.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.341 -0.849 . . . . 0.0 110.581 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tt -117.41 157.65 25.84 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -135.16 148.27 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.03 -1.044 . . . . 0.0 109.248 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -108.06 113.95 27.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.356 -0.84 . . . . 0.0 109.827 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.426 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 66.6 t-105 -94.66 111.17 22.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.018 -1.051 . . . . 0.0 109.604 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 20.8 mm -112.24 92.99 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -53.29 149.29 12.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -94.35 35.24 1.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.32 -1.106 . . . . 0.0 109.554 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.534 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -153.29 25.97 0.53 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 87' ' ' SER . 4.0 p -98.11 159.63 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.15 -0.968 . . . . 0.0 109.725 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.416 ' H ' HG22 ' A' ' 86' ' ' VAL . 7.4 p -71.9 -176.24 1.64 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.0 110.01 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.19 -18.19 63.28 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -46.4 -57.2 4.87 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.083 -1.245 . . . . 0.0 109.618 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 49.0 mm-40 -57.51 -30.97 65.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.208 -0.933 . . . . 0.0 109.23 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 6.6 tpt180 -45.33 -56.42 4.94 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.053 -1.03 . . . . 0.0 109.425 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.82 -35.2 38.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.823 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 10.2 mttt -69.66 -61.64 1.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.128 -0.982 . . . . 0.0 109.875 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.588 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 28.4 m -45.02 -49.83 11.11 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.0 109.65 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -51.66 -59.43 8.55 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.501 ' HG1' ' H ' ' A' ' 97' ' ' ASP . 74.1 p -65.01 -48.29 74.44 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.014 -1.286 . . . . 0.0 111.173 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -69.08 -41.1 77.97 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.82 -1.175 . . . . 0.0 111.617 -177.535 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.404 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -61.23 -22.18 64.55 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.768 -1.208 . . . . 0.0 109.459 -179.416 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 20.4 m -73.92 -44.85 53.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.227 -0.92 . . . . 0.0 109.426 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 8.1 mp -59.13 -54.73 43.63 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.204 -0.935 . . . . 0.0 109.586 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -28.05 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.164 -0.96 . . . . 0.0 109.914 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.72 -37.93 73.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.14 -0.975 . . . . 0.0 109.784 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -22.39 60.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.158 -0.964 . . . . 0.0 109.732 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.518 ' CG1' ' O ' ' A' ' 104' ' ' VAL . 88.6 t -94.26 33.82 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.55 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.1 t -131.75 98.93 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.298 -0.876 . . . . 0.0 109.873 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.595 ' O ' ' N ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -119.1 -41.4 2.75 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.69 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 33.2 p-10 -63.9 41.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 119.936 -0.705 . . . . 0.0 110.073 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.595 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -142.4 174.69 10.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.345 -0.847 . . . . 0.0 109.601 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -88.07 -56.76 3.19 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.205 -0.934 . . . . 0.0 109.5 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.548 ' HZ1' ' HE1' ' A' ' 112' ' ' PHE . 9.3 ttpp -162.37 167.17 24.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.294 -0.878 . . . . 0.0 109.33 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.514 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -104.37 154.06 20.3 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.192 -0.943 . . . . 0.0 108.968 179.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.548 ' HE1' ' HZ1' ' A' ' 110' ' ' LYS . 58.3 m-85 -128.61 156.2 43.74 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.444 -0.785 . . . . 0.0 110.166 -179.248 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 33.4 t -115.16 143.11 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 18.8 mm -136.08 154.07 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.078 -1.013 . . . . 0.0 110.439 -179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 64.4 m -140.59 3.6 1.9 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.611 -0.681 . . . . 0.0 109.218 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 1.164 ' OD1' ' CD ' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -143.12 155.29 44.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.189 -0.945 . . . . 0.0 109.526 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -73.96 -33.25 63.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 109.824 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.61 -8.76 54.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.199 -0.938 . . . . 0.0 109.007 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 1.164 ' CD ' ' OD1' ' A' ' 116' ' ' ASP . 21.7 mt-10 -86.35 -0.48 56.0 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -94.71 1.29 55.49 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.214 -0.929 . . . . 0.0 108.814 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.45 145.77 54.96 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.538 -0.726 . . . . 0.0 109.701 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -62.33 -49.24 76.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 0.0 109.581 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.15 -21.94 15.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.0 109.852 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 67.5 t80 -83.31 -49.21 9.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.301 -0.874 . . . . 0.0 109.148 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.5 mm -71.94 -25.2 23.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -65.09 -52.39 55.83 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.198 -0.939 . . . . 0.0 108.729 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.3 t -58.74 -24.5 61.71 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.323 -0.861 . . . . 0.0 109.197 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.84 -40.65 65.57 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.295 -0.878 . . . . 0.0 109.268 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.404 ' C ' ' H ' ' A' ' 131' ' ' LYS . 19.2 mt -73.64 -53.11 11.21 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.219 -0.925 . . . . 0.0 109.131 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 130' ' ' LYS . 11.3 mptt -60.35 -7.25 1.9 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.143 -0.973 . . . . 0.0 109.601 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.404 ' H ' ' C ' ' A' ' 129' ' ' LEU . 0.3 OUTLIER -76.27 -60.21 2.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.908 . . . . 0.0 109.402 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -138.09 102.68 4.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.266 -0.896 . . . . 0.0 109.445 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -163.06 46.55 0.33 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.538 ' O ' ' N ' ' A' ' 136' ' ' ASN . . . -156.57 -74.86 0.02 OUTLIER Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.89 72.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.272 -1.134 . . . . 0.0 109.494 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.538 ' N ' ' O ' ' A' ' 134' ' ' GLY . 5.3 t-20 -104.08 67.41 0.86 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.291 -0.881 . . . . 0.0 109.535 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.515 ' CD1' ' O ' ' A' ' 137' ' ' TYR . 0.4 OUTLIER -98.7 -36.96 9.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.273 -0.892 . . . . 0.0 109.466 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.539 ' C ' ' H ' ' A' ' 140' ' ' GLN . 0.0 OUTLIER -42.99 -34.94 1.08 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.287 -0.883 . . . . 0.0 109.535 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 52.1 7.66 0.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.234 -0.916 . . . . 0.0 109.475 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.539 ' H ' ' C ' ' A' ' 138' ' ' ASP . 1.0 OUTLIER -91.23 110.49 21.77 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.29 -0.881 . . . . 0.0 109.495 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.32 112.29 23.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.226 -0.922 . . . . 0.0 109.45 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.451 179.936 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.2 mtt . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.436 ' C ' ' OG1' ' A' ' 3' ' ' THR . . . -96.8 130.75 44.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.283 -0.886 . . . . 0.0 109.505 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.436 ' OG1' ' C ' ' A' ' 2' ' ' ALA . 0.1 OUTLIER 63.03 138.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.291 -0.881 . . . . 0.0 109.402 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -137.32 118.21 14.22 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.275 -0.891 . . . . 0.0 109.364 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 tt -110.79 142.72 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.404 -0.81 . . . . 0.0 109.615 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 8' ' ' GLU . 4.5 m-20 -93.4 40.84 1.07 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.189 -0.944 . . . . 0.0 109.154 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.44 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -40.17 -22.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.712 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.57 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.3 tt0 -50.32 -34.05 22.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.186 -0.946 . . . . 0.0 109.232 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.8 -60.25 2.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.357 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.89 -62.82 1.08 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.209 -0.932 . . . . 0.0 109.682 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.654 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 38.7 ttp180 -45.17 -53.66 7.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.951 -1.093 . . . . 0.0 109.221 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -58.29 8.49 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.339 -0.85 . . . . 0.0 109.757 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.55 -25.57 62.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.535 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -70.76 -48.31 55.02 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.368 -0.832 . . . . 0.0 109.492 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.705 ' ND2' HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -79.58 -11.06 59.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.272 -0.893 . . . . 0.0 109.555 -179.994 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.6 tp -76.76 -29.01 55.93 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.265 -0.897 . . . . 0.0 109.212 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.43 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 0.8 OUTLIER -72.1 -1.57 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.298 -0.876 . . . . 0.0 109.194 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.512 ' CG ' ' O ' ' A' ' 18' ' ' ARG . 22.1 ttp180 -118.76 -1.03 11.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.535 -0.728 . . . . 0.0 109.188 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.3 OUTLIER -94.58 26.86 3.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.206 -0.934 . . . . 0.0 109.969 -179.57 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.532 ' C ' ' O ' ' A' ' 19' ' ' ASP . 4.9 m-20 29.55 35.53 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.766 -0.584 . . . . 0.0 110.406 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.595 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . -121.36 -76.1 0.41 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 37.1 t -67.97 -30.72 70.06 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.212 -1.169 . . . . 0.0 110.089 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.592 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . 68.52 4.94 4.54 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.093 -1.004 . . . . 0.0 109.659 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.448 ' O ' ' C ' ' A' ' 25' ' ' ILE . 2.5 p -58.41 78.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.98 . . . . 0.0 108.94 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -41.02 -59.04 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 O-C-N 121.409 -0.807 . . . . 0.0 109.949 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.621 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 27.0 p-90 -134.02 156.49 48.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.826 -1.171 . . . . 0.0 110.834 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.5 p -134.27 135.77 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.7 p -124.28 146.22 48.91 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.097 -1.002 . . . . 0.0 110.541 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.92 136.9 54.19 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 32' ' ' ASP . 26.9 ptt180 -113.47 146.1 40.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.487 -0.758 . . . . 0.0 109.982 -178.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.681 ' CD2' ' NE2' ' A' ' 90' ' ' GLN . 1.9 m-85 -41.21 98.63 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.565 -0.709 . . . . 0.0 109.781 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -97.1 101.76 13.4 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 55.83 -119.35 13.74 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.83 22.46 15.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.453 -1.028 . . . . 0.0 110.098 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 43.8 m -145.31 134.06 22.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.123 -0.986 . . . . 0.0 109.909 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.3 mp -78.98 113.45 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.284 -0.885 . . . . 0.0 108.997 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.41 150.5 72.59 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.286 -0.884 . . . . 0.0 109.871 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -35.53 146.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.895 2.397 . . . . 0.0 112.303 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.99 -38.64 0.15 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.565 ' CG ' HE22 ' A' ' 51' ' ' GLN . 3.5 m-20 -142.62 -179.38 6.27 Favored 'General case' 0 C--N 1.296 -1.761 0 O-C-N 121.714 -0.874 . . . . 0.0 109.285 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.74 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -158.12 -169.39 2.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.354 -0.841 . . . . 0.0 109.685 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.15 143.96 7.75 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 119.521 -1.323 . . . . 0.0 110.163 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.04 0.29 29.65 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -152.29 170.71 19.37 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.425 ' O ' ' C ' ' A' ' 46' ' ' GLN . 17.8 p90 -79.63 -39.72 30.89 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.625 -1.297 . . . . 0.0 109.03 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 45' ' ' TYR . 6.0 mm-40 -42.42 -33.84 0.73 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.078 -1.014 . . . . 0.0 109.994 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.518 ' NE2' ' OE1' ' A' ' 50' ' ' GLN . 2.1 t-160 -61.74 -41.75 98.06 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.82 -1.175 . . . . 0.0 109.108 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.609 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -47.67 -33.22 6.56 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.63 -42.11 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.158 -0.964 . . . . 0.0 109.111 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.574 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 5.3 tm0? -86.96 -12.62 47.0 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.573 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 1.5 mm100 -109.97 67.25 0.64 Allowed 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.313 1.054 . . . . 0.0 110.472 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.573 ' SG ' ' O ' ' A' ' 51' ' ' GLN . 1.2 m 158.61 59.19 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.009 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.427 ' O ' ' NE1' ' A' ' 81' ' ' TRP . 1.4 p -77.41 164.02 25.86 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.966 -1.084 . . . . 0.0 109.707 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.3 OUTLIER -65.46 -4.52 5.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.632 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.29 14.46 31.89 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.282 -0.886 . . . . 0.0 109.504 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.5 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 2.5 p -138.18 157.14 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.236 -0.915 . . . . 0.0 109.745 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.522 ' N ' ' CD ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -134.76 129.03 34.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.554 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.498 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.7 pp -172.49 172.73 4.25 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 110.294 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -104.34 153.55 20.92 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.117 -0.99 . . . . 0.0 108.846 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -133.05 156.93 46.48 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.404 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 47.7 t80 -148.91 96.54 2.57 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -113.5 159.27 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.31 -0.868 . . . . 0.0 109.609 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.583 ' NE ' ' OG ' ' A' ' 74' ' ' SER . 1.1 ttt-85 -84.7 140.65 31.14 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.299 -0.875 . . . . 0.0 108.735 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -123.62 156.05 36.55 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.807 . . . . 0.0 110.221 -179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.6 t -77.22 135.11 38.46 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.1 m -109.61 37.79 2.53 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.476 -0.765 . . . . 0.0 109.5 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.588 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 173.01 108.98 0.22 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.486 ' OD1' ' NH1' ' A' ' 126' ' ' ARG . 1.0 OUTLIER -43.12 91.72 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.225 -1.162 . . . . 0.0 109.506 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.588 ' N ' ' O ' ' A' ' 67' ' ' GLY . . . 55.09 43.04 30.24 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.0 109.438 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 19.6 ttt -146.64 156.95 43.59 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.331 -0.856 . . . . 0.0 109.482 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.57 148.53 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.211 -0.93 . . . . 0.0 109.488 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -99.14 -24.84 14.73 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.9 mtm180 -58.11 174.93 0.24 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 0.0 109.432 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.583 ' OG ' ' NE ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -138.39 171.28 14.61 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.295 -0.878 . . . . 0.0 109.444 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.93 155.38 19.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.84 . . . . 0.0 109.311 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.413 ' O ' ' N ' ' A' ' 109' ' ' ALA . 93.8 m-85 -134.02 120.25 20.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.394 -0.816 . . . . 0.0 109.746 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.74 167.2 22.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.604 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tt -121.18 155.42 34.59 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.2 mm -134.7 143.06 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.168 -0.957 . . . . 0.0 109.046 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.7 m -104.14 117.06 33.36 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 109.674 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.5 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -92.97 111.49 23.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.048 -1.033 . . . . 0.0 109.69 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -110.11 93.12 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.323 -0.861 . . . . 0.0 108.746 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.07 158.7 3.0 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -96.95 19.88 12.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.295 -1.121 . . . . 0.0 109.734 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -132.16 26.81 4.53 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.865 . . . . 0.0 109.215 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.1 t -91.21 160.98 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.357 -0.839 . . . . 0.0 110.094 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 t -93.37 -161.32 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.379 -0.825 . . . . 0.0 108.985 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -20.62 59.19 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.969 -1.253 . . . . 0.0 109.969 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.59 -64.65 0.71 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.987 -1.302 . . . . 0.0 110.023 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.681 ' NE2' ' CD2' ' A' ' 31' ' ' TYR . 10.8 mm100 -56.75 -30.22 63.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.8 tmm_? -49.6 -59.51 3.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.798 -1.188 . . . . 0.0 109.633 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.38 -39.88 27.58 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.174 -0.954 . . . . 0.0 109.796 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.447 ' C ' ' OH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -60.27 -65.3 0.71 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 109.515 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 51.1 m -45.16 -43.11 9.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.0 109.572 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.07 -60.45 3.5 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.8 m -66.05 -47.95 72.65 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.118 -1.225 . . . . 0.0 111.075 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -68.77 -42.86 76.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.78 -1.2 . . . . 0.0 111.386 -177.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -25.12 53.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.595 -1.316 . . . . 0.0 108.745 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 96.1 m -81.33 -20.7 40.14 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 53.2 mt -78.98 -63.79 1.33 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.44 -0.787 . . . . 0.0 109.185 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -50.3 -33.11 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.975 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.98 ' HE2' ' HG2' ' A' ' 111' ' ' GLU . 1.4 tttm -75.07 -42.37 57.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.269 -0.894 . . . . 0.0 109.751 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.31 -39.33 85.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.168 -0.957 . . . . 0.0 110.203 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.437 ' O ' ' C ' ' A' ' 105' ' ' VAL . 12.8 p -78.16 -25.68 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.07 -1.018 . . . . 0.0 109.926 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.437 ' C ' ' O ' ' A' ' 104' ' ' VAL . 1.0 OUTLIER -42.8 138.4 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.105 -0.997 . . . . 0.0 109.518 -179.927 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.47 ' NE2' ' CD ' ' A' ' 11' ' ' ARG . 11.6 pt20 -144.29 20.07 1.73 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.072 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.705 HD21 ' ND2' ' A' ' 15' ' ' ASN . 1.4 t-20 -143.18 41.16 1.5 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.896 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.566 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -142.52 158.0 44.14 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.032 . . . . 0.0 109.867 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.413 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -93.6 -34.34 13.35 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.354 -0.842 . . . . 0.0 109.446 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -162.27 159.54 25.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.871 . . . . 0.0 109.314 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.98 ' HG2' ' HE2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -104.2 150.69 24.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.199 -0.938 . . . . 0.0 109.337 -179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -133.84 157.62 45.46 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.451 -0.78 . . . . 0.0 109.701 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.6 t -121.19 142.47 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.427 ' CG2' ' N ' ' A' ' 115' ' ' SER . 1.8 mm -137.26 156.59 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.899 . . . . 0.0 110.058 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.482 ' O ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -140.64 9.19 2.2 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.607 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -158.79 157.05 30.88 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -79.74 -18.96 49.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.918 -1.114 . . . . 0.0 110.209 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -62.8 -50.06 72.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.087 -1.008 . . . . 0.0 110.428 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.607 ' OE2' ' N ' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -80.79 4.74 18.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 0.0 110.279 -179.098 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.429 ' N ' ' OE1' ' A' ' 119' ' ' GLU . 0.7 OUTLIER -96.38 16.62 17.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.007 -1.058 . . . . 0.0 108.405 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -74.63 154.6 38.45 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.66 -0.65 . . . . 0.0 109.78 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.41 -48.22 74.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.424 -0.798 . . . . 0.0 109.49 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 1.3 p30 -56.97 -41.59 78.62 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 109.658 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CG ' ' O ' ' A' ' 119' ' ' GLU . 15.4 t80 -60.36 -48.0 83.62 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.094 0.95 . . . . 0.0 109.093 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.4 mm -71.22 -40.15 74.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.486 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 33.5 ttp180 -62.14 -53.37 56.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.203 -0.935 . . . . 0.0 109.039 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -15.06 13.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.384 -0.822 . . . . 0.0 109.49 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.422 ' OE2' ' CZ ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -83.52 -37.24 23.32 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.21 -0.931 . . . . 0.0 109.358 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.616 ' C ' ' H ' ' A' ' 131' ' ' LYS . 46.8 mt -69.08 -39.72 78.88 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.193 -0.942 . . . . 0.0 108.631 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.444 ' NZ ' ' CB ' ' A' ' 132' ' ' ALA . 0.2 OUTLIER -53.23 -5.43 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.137 -0.977 . . . . 0.0 108.645 179.135 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.616 ' H ' ' C ' ' A' ' 129' ' ' LEU . 11.2 tttt 60.93 102.56 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.71 0.767 . . . . 0.0 109.477 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.444 ' CB ' ' NZ ' ' A' ' 130' ' ' LYS . . . -141.54 -33.88 0.49 Allowed 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.551 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -95.92 138.72 14.1 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.412 ' O ' ' CB ' ' A' ' 135' ' ' ALA . . . 153.78 170.01 19.35 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . 69.78 43.07 0.99 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.215 -1.168 . . . . 0.0 109.459 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' A' ' 135' ' ' ALA . 8.3 p30 43.29 18.1 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.171 -0.956 . . . . 0.0 109.401 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.585 ' N ' ' O ' ' A' ' 135' ' ' ALA . 10.6 t80 -75.71 5.28 6.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.282 -0.886 . . . . 0.0 109.471 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.519 ' C ' ' H ' ' A' ' 140' ' ' GLN . 66.5 m-20 -90.66 -72.07 0.59 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.259 -0.901 . . . . 0.0 109.456 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.21 4.86 0.43 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.304 -0.873 . . . . 0.0 109.437 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.519 ' H ' ' C ' ' A' ' 138' ' ' ASP . 17.4 mt-30 53.62 -175.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 109.41 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 5.4 p -83.1 -171.34 3.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.287 -0.883 . . . . 0.0 109.444 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 118.08 -0.962 . . . . 0.0 109.498 -179.993 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.494 ' O ' ' CB ' ' A' ' 2' ' ' ALA . 15.5 ttt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.494 ' CB ' ' O ' ' A' ' 1' ' ' MET . . . 74.47 -60.26 0.53 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.867 . . . . 0.0 109.466 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.4 m -90.3 151.27 21.56 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.299 -0.876 . . . . 0.0 109.395 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.26 125.1 21.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.185 -0.947 . . . . 0.0 109.44 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.3 137.25 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.391 -0.818 . . . . 0.0 109.694 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.558 ' O ' ' N ' ' A' ' 8' ' ' GLU . 6.3 t70 -64.04 -44.61 91.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -0.89 . . . . 0.0 109.381 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt 63.89 -50.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.445 -0.785 . . . . 0.0 110.184 179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 6' ' ' ASP . 10.9 mt-10 -51.8 -49.29 63.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.111 -0.993 . . . . 0.0 109.809 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.69 -69.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 109.999 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.651 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 4.1 m -46.08 -65.34 0.56 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.22 -0.925 . . . . 0.0 110.125 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.515 ' CZ ' ' CB ' ' A' ' 11' ' ' ARG . 0.9 OUTLIER -44.78 -58.39 3.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.985 -1.072 . . . . 0.0 110.144 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.95 -45.28 78.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.131 -0.981 . . . . 0.0 110.049 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.88 -17.02 59.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.058 -1.026 . . . . 0.0 110.183 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-30 -74.27 -52.96 10.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.125 -0.984 . . . . 0.0 109.539 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.671 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 1.8 m-80 -71.93 -13.32 61.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 109.42 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.8 tp -70.87 -47.99 56.23 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.356 -0.84 . . . . 0.0 109.575 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.7 m -64.97 -14.0 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.218 -0.926 . . . . 0.0 109.563 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.573 ' NH2' ' OD1' ' A' ' 15' ' ' ASN . 20.1 ttm180 -71.83 -26.58 62.44 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.267 -0.896 . . . . 0.0 109.508 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.481 ' O ' ' O ' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -59.84 -144.76 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.226 -0.921 . . . . 0.0 109.449 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -111.62 51.95 0.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.445 -0.785 . . . . 0.0 109.302 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 79.85 64.16 1.91 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.9 t -85.14 -49.09 8.53 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.316 -1.108 . . . . 0.0 109.605 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.543 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . -178.89 -157.9 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.198 -0.938 . . . . 0.0 109.71 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.543 ' C ' ' O ' ' A' ' 23' ' ' ALA . 9.1 m 21.5 69.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-O 120.821 0.343 . . . . 0.0 111.378 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 24' ' ' VAL . 13.0 tt -46.77 -31.06 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 120.743 -1.223 . . . . 0.0 108.08 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.624 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 22.8 p-90 -157.16 147.63 21.22 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.295 -0.878 . . . . 0.0 109.372 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.84 135.09 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.334 -0.854 . . . . 0.0 110.091 -179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.405 HG21 ' CZ3' ' A' ' 26' ' ' TRP . 47.5 p -131.18 133.88 45.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.48 -0.762 . . . . 0.0 109.73 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.651 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.44 167.28 14.06 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -140.89 143.75 34.84 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 119.231 -0.987 . . . . 0.0 109.813 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.483 ' OH ' ' OG1' ' A' ' 94' ' ' THR . 5.6 m-85 -50.37 98.68 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.544 -0.723 . . . . 0.0 109.744 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.66 101.35 13.04 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.08 -122.71 13.39 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.89 22.31 16.09 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.46 -1.023 . . . . 0.0 110.227 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 35.4 m -146.6 136.0 22.86 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.066 -1.021 . . . . 0.0 109.694 179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mp -77.56 115.8 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.108 -0.995 . . . . 0.0 108.768 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -135.31 154.13 78.47 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.244 -0.91 . . . . 0.0 109.822 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -39.67 141.59 0.55 Allowed 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.752 2.301 . . . . 0.0 112.388 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.28 -40.8 0.17 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.597 ' CG ' ' H ' ' A' ' 41' ' ' GLN . 14.8 t70 -144.19 179.65 7.09 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.75 -0.853 . . . . 0.0 108.83 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.82 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -140.81 177.11 8.26 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.406 -0.808 . . . . 0.0 110.546 -179.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . -112.19 85.14 0.38 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.592 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -113.77 43.74 1.75 Allowed 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER 143.41 125.55 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.911 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -54.65 -53.86 49.23 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 0.0 109.551 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.462 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 5.1 mp0 -48.54 -20.22 0.41 Allowed 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.2 -0.938 . . . . 0.0 109.79 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.584 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -71.77 -34.01 69.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.195 -0.94 . . . . 0.0 109.225 179.655 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.592 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -56.03 -40.12 73.0 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.433 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.523 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.3 mt -58.74 -55.08 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.902 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -73.27 7.15 2.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.013 -1.055 . . . . 0.0 108.361 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.543 ' NE2' ' CG ' ' A' ' 40' ' ' ASP . 9.1 mm100 -116.07 -75.73 0.58 Allowed 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.17 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.552 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 2.5 m -65.82 48.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.125 -0.984 . . . . 0.0 109.496 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.534 ' N ' ' O ' ' A' ' 51' ' ' GLN . 0.7 OUTLIER -73.75 172.5 11.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.181 -0.949 . . . . 0.0 109.739 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.58 ' OD1' ' N ' ' A' ' 55' ' ' ASP . 1.1 p30 -55.27 -48.27 74.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.273 -0.892 . . . . 0.0 109.763 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.58 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.5 OUTLIER -76.28 42.21 0.26 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 -179.874 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.561 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 96.0 t -148.19 147.18 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 109.836 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -138.38 120.91 16.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.404 -0.81 . . . . 0.0 109.516 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.495 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.5 pp -172.86 175.97 3.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.076 -1.015 . . . . 0.0 110.462 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.424 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 3.9 m-85 -104.46 152.03 22.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.984 -1.072 . . . . 0.0 108.807 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -133.43 152.04 51.87 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.965 -1.085 . . . . 0.0 109.017 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.461 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 39.5 t80 -150.82 96.93 2.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.076 . . . . 0.0 109.498 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.55 154.89 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.248 -0.907 . . . . 0.0 108.949 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -80.7 113.29 18.79 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.359 -0.838 . . . . 0.0 108.983 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.561 ' CE2' ' HB2' ' A' ' 77' ' ' ALA . 12.5 m-85 -93.87 155.8 16.99 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.88 . . . . 0.0 109.661 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.97 149.62 34.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.164 -0.96 . . . . 0.0 108.97 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.435 ' HG1' ' CD ' ' A' ' 75' ' ' LYS . 90.5 m -109.96 -78.07 0.59 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.438 -0.789 . . . . 0.0 109.473 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.49 -31.06 6.32 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.4 -62.61 1.56 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.257 -1.143 . . . . 0.0 109.494 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -45.03 153.7 0.18 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.208 -0.932 . . . . 0.0 109.521 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.7 ttm -47.3 -42.82 21.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.252 -0.905 . . . . 0.0 109.42 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.91 -139.28 0.33 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.454 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 73' ' ' ARG . 16.4 mttt -99.77 -77.14 0.53 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.197 -0.939 . . . . 0.0 109.557 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.524 ' CB ' ' O ' ' A' ' 72' ' ' LYS . 12.2 ttp180 77.04 -44.0 0.45 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.255 -0.903 . . . . 0.0 109.444 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 0.4 OUTLIER 73.49 153.06 0.13 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.313 -0.867 . . . . 0.0 109.487 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 64' ' ' PHE . 0.6 OUTLIER -104.74 157.69 17.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.393 -0.817 . . . . 0.0 109.89 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -133.26 119.73 20.18 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.458 -0.776 . . . . 0.0 109.054 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.561 ' HB2' ' CE2' ' A' ' 64' ' ' PHE . . . -144.09 156.8 44.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.091 -1.006 . . . . 0.0 110.947 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.6 tt -106.57 157.29 17.79 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.455 ' CG2' ' CG1' ' A' ' 114' ' ' ILE . 36.9 mt -137.36 133.26 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 120.92 -1.113 . . . . 0.0 109.066 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.3 m -95.72 117.76 31.12 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.165 -0.959 . . . . 0.0 109.653 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.561 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -93.02 110.38 21.85 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.089 -1.007 . . . . 0.0 109.729 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -105.21 93.01 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.09 156.35 19.76 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.565 ' C ' ' H ' ' A' ' 86' ' ' VAL . 2.9 mm-40 -78.72 -51.47 9.76 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -1.163 . . . . 0.0 109.63 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -67.0 39.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.183 -0.948 . . . . 0.0 109.57 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.565 ' H ' ' C ' ' A' ' 84' ' ' GLU . 92.8 t -96.63 157.3 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.23 -0.919 . . . . 0.0 109.725 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.2 p -99.38 -161.49 0.88 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.324 -0.86 . . . . 0.0 109.461 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.03 -15.97 68.54 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.8 mp -46.93 -54.27 10.44 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.073 -1.251 . . . . 0.0 109.408 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.685 ' NE2' ' N ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -57.29 -35.16 69.46 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.865 . . . . 0.0 109.165 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.685 ' N ' ' NE2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -47.6 -62.72 1.31 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.061 -1.024 . . . . 0.0 109.961 -179.358 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.09 -40.52 19.72 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.13 -0.981 . . . . 0.0 110.132 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.444 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 56.8 mmtt -61.66 -59.05 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 0.0 110.312 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.483 ' OG1' ' OH ' ' A' ' 31' ' ' TYR . 27.3 m -55.78 -49.09 74.1 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.962 -1.086 . . . . 0.0 109.516 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.474 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.87 -62.12 2.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.7 p -64.91 -49.26 71.11 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.118 -1.225 . . . . 0.0 111.104 -178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.563 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -66.85 -42.18 86.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.914 -1.116 . . . . 0.0 111.401 -177.824 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -22.64 63.55 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.623 -1.298 . . . . 0.0 109.201 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -82.3 -21.47 36.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.368 -0.833 . . . . 0.0 108.812 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.4 mt -83.46 -61.94 1.71 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.397 -0.815 . . . . 0.0 109.272 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.508 ' CG1' ' N ' ' A' ' 102' ' ' LYS . 8.6 p -46.78 -46.85 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.76 ' HD3' ' OE2' ' A' ' 111' ' ' GLU . 3.3 ttmt -66.31 -44.29 83.82 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.232 -0.918 . . . . 0.0 109.615 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' A' ' 105' ' ' VAL . 12.2 mt-10 -47.98 -68.53 0.18 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.221 -0.925 . . . . 0.0 110.153 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.414 ' O ' ' CG2' ' A' ' 104' ' ' VAL . 14.5 p -74.16 42.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -0.947 . . . . 0.0 110.05 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.426 ' H ' ' C ' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -121.0 167.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.417 -0.802 . . . . 0.0 109.712 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.621 ' C ' ' H ' ' A' ' 108' ' ' PHE . 3.1 pt20 -177.21 -29.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.671 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 1.3 m-20 -66.77 26.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.528 -0.732 . . . . 0.0 109.738 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.621 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -139.82 154.29 47.31 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.0 109.478 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.43 -31.98 14.4 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.476 -0.765 . . . . 0.0 109.778 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -162.35 152.37 16.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.76 ' OE2' ' HD3' ' A' ' 102' ' ' LYS . 7.8 pt-20 -104.87 156.9 17.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.894 . . . . 0.0 108.682 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -142.28 158.35 43.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.943 -1.098 . . . . 0.0 110.894 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.1 p -117.01 158.12 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.455 ' CG1' ' CG2' ' A' ' 79' ' ' ILE . 4.4 mm -138.07 154.5 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.083 -1.011 . . . . 0.0 110.314 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.63 -0.12 2.92 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.412 ' H ' HG21 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -155.08 155.35 33.92 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.381 -0.824 . . . . 0.0 109.072 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -74.39 -24.75 59.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.005 . . . . 0.0 109.912 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.528 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 1.0 OUTLIER -68.82 -14.52 63.08 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.135 -0.978 . . . . 0.0 109.144 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.585 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 10.2 mm-40 -87.09 4.1 43.51 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.767 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 9.2 mt -107.18 31.17 5.57 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.278 -0.889 . . . . 0.0 109.577 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 118' ' ' LYS . 1.6 mt-10 -79.27 138.08 37.63 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.044 -1.035 . . . . 0.0 109.903 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -46.0 -53.75 9.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.095 -1.003 . . . . 0.0 109.477 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . 0.733 ' OD1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -60.78 -38.6 85.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.277 -0.89 . . . . 0.0 109.735 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.585 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 20.8 t80 -61.06 -48.18 82.94 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.208 -0.932 . . . . 0.0 109.157 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.0 mm -58.96 -21.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.562 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -82.24 -44.97 15.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.129 -0.982 . . . . 0.0 109.838 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.7 t -58.33 -30.94 67.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.246 -0.909 . . . . 0.0 109.842 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -85.24 -38.93 18.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.582 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.2 -27.82 66.72 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.122 -0.986 . . . . 0.0 109.295 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -49.45 -46.39 47.82 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.172 -0.955 . . . . 0.0 109.106 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 132' ' ' ALA . 5.0 tmtt? -169.86 -53.12 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.437 -0.79 . . . . 0.0 109.267 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 131' ' ' LYS . . . 45.62 92.95 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.44 -0.787 . . . . 0.0 109.514 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -101.89 -43.94 2.01 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.476 ' O ' ' CB ' ' A' ' 135' ' ' ALA . . . 101.89 -94.67 1.23 Allowed Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.569 -1.413 . . . . 0.0 109.569 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.476 ' CB ' ' O ' ' A' ' 134' ' ' GLY . . . 73.38 -1.36 3.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.264 -1.139 . . . . 0.0 109.519 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.572 ' C ' HD21 ' A' ' 136' ' ' ASN . 0.4 OUTLIER -95.66 41.94 1.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.178 -0.952 . . . . 0.0 109.536 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.541 ' CG ' ' O ' ' A' ' 137' ' ' TYR . 66.2 t80 -144.16 29.16 1.33 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.24 -0.913 . . . . 0.0 109.484 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.432 ' CG ' ' N ' ' A' ' 139' ' ' ALA . 2.6 p-10 -162.59 -42.98 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.271 -0.893 . . . . 0.0 109.493 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.432 ' N ' ' CG ' ' A' ' 138' ' ' ASP . . . -101.15 31.87 3.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.561 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -50.34 -50.14 51.88 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.272 -0.892 . . . . 0.0 109.48 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.7 t -51.9 151.48 3.52 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.215 -0.928 . . . . 0.0 109.474 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.077 -0.963 . . . . 0.0 109.445 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.532 ' O ' ' CB ' ' A' ' 2' ' ' ALA . 3.9 mtp . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.532 ' CB ' ' O ' ' A' ' 1' ' ' MET . . . 77.09 14.9 1.9 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.255 -0.903 . . . . 0.0 109.502 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 2' ' ' ALA . 4.1 m 60.83 135.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.234 -0.916 . . . . 0.0 109.412 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.1 mttp -128.77 124.06 34.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.466 -0.771 . . . . 0.0 109.442 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.0 tp -107.59 130.32 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.379 -0.825 . . . . 0.0 109.476 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -102.86 60.89 0.79 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.148 -0.97 . . . . 0.0 109.451 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.669 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -45.52 -14.11 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.065 -1.022 . . . . 0.0 109.51 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 6' ' ' ASP . 4.0 mt-10 -55.53 -50.74 69.19 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.199 -0.938 . . . . 0.0 109.443 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.29 -58.19 6.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 109.383 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.588 ' SG ' ' CZ ' ' A' ' 29' ' ' PHE . 3.3 m -57.05 -65.17 0.66 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 109.776 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.586 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 9.7 tmm_? -44.62 -57.68 3.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.981 -1.075 . . . . 0.0 109.959 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.64 -33.05 53.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.169 -0.957 . . . . 0.0 109.366 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.2 -39.69 25.03 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.75 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.667 ' CZ ' ' CG ' ' A' ' 61' ' ' PHE . 1.5 m-85 -50.27 -49.23 53.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.23 -0.919 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.708 ' H ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -80.13 -17.42 52.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.099 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.1 tp -70.61 -22.72 62.51 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.425 ' C ' ' H ' ' A' ' 19' ' ' ASP . 4.5 m -92.0 -3.09 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.91 . . . . 0.0 109.529 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.639 HH11 ' CG ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -63.21 -4.05 2.23 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.317 -0.865 . . . . 0.0 109.382 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.591 ' C ' ' H ' ' A' ' 21' ' ' GLY . 0.7 OUTLIER -97.09 158.8 15.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.326 -0.859 . . . . 0.0 109.6 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.37 16.56 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 109.536 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.591 ' H ' ' C ' ' A' ' 19' ' ' ASP . . . 147.71 75.93 0.02 OUTLIER Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.175 -1.57 . . . . 0.0 109.175 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.99 -46.2 4.95 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.266 -1.138 . . . . 0.0 109.864 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . -166.85 -141.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.036 -1.04 . . . . 0.0 110.405 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.515 ' O ' ' CG2' ' A' ' 24' ' ' VAL . 2.4 m -39.18 123.53 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.512 -0.742 . . . . 0.0 110.494 -179.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.441 HG21 ' H ' ' A' ' 26' ' ' TRP . 0.3 OUTLIER -63.09 -55.0 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.597 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 17.7 p-90 -128.86 165.13 21.61 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -133.48 133.52 57.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.24 -0.912 . . . . 0.0 109.278 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 72.5 p -125.87 137.83 53.76 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.283 -0.885 . . . . 0.0 109.65 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.657 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.65 163.56 16.27 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 178.475 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.661 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -141.0 142.22 34.27 Favored 'General case' 0 C--N 1.294 -1.831 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.538 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.607 ' HH ' ' N ' ' A' ' 94' ' ' THR . 6.6 m-85 -42.76 98.55 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.486 -0.759 . . . . 0.0 109.887 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 30' ' ' ARG . 1.3 t0 -97.97 101.59 13.12 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 57.68 -120.18 20.12 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.076 -1.61 . . . . 0.0 109.076 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.67 22.94 15.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -1.06 . . . . 0.0 110.292 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.8 m -143.47 134.95 26.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.107 -0.996 . . . . 0.0 110.014 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.54 ' CD1' ' OD2' ' A' ' 97' ' ' ASP . 1.6 mp -84.44 110.27 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.302 -0.874 . . . . 0.0 108.969 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 m -135.8 158.58 73.78 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.277 -0.889 . . . . 0.0 109.662 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -50.74 135.78 42.23 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.754 2.303 . . . . 0.0 111.585 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.422 ' HA3' HH11 ' A' ' 30' ' ' ARG . . . -130.4 -22.96 1.04 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.605 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.8 m-20 -142.68 -178.35 5.74 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.492 -1.005 . . . . 0.0 109.425 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.835 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -163.22 -176.99 5.1 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.435 -0.79 . . . . 0.0 109.764 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -157.27 141.92 8.23 Favored Glycine 0 N--CA 1.489 2.174 0 C-N-CA 119.549 -1.31 . . . . 0.0 109.9 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.3 -8.8 18.03 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -157.52 174.83 14.78 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.574 ' CZ ' ' CE2' ' A' ' 48' ' ' PHE . 31.0 t80 -73.68 -10.64 59.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.277 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.572 ' O ' ' CD1' ' A' ' 49' ' ' ILE . 46.0 mm-40 -75.61 -30.29 59.51 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.187 -0.946 . . . . 0.0 110.636 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.533 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -79.36 -4.0 48.87 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.609 -1.307 . . . . 0.0 110.044 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.574 ' CE2' ' CZ ' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -83.13 -51.51 7.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.835 -1.166 . . . . 0.0 110.193 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.677 ' CD1' ' H ' ' A' ' 49' ' ' ILE . 0.1 OUTLIER -63.03 -32.66 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 120.876 -1.14 . . . . 0.0 109.137 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.93 -21.5 60.87 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.605 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.0 OUTLIER -96.46 -15.1 21.92 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.527 -179.187 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.565 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 7.5 m -117.92 52.44 1.0 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.414 -0.804 . . . . 0.0 110.228 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 55' ' ' ASP . 23.3 p -72.48 166.87 21.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.911 -1.118 . . . . 0.0 109.266 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -70.47 12.21 0.27 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 109.768 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.498 ' H ' ' C ' ' A' ' 53' ' ' THR . 5.9 m-20 -120.49 24.82 10.15 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.398 -0.814 . . . . 0.0 109.749 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.418 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 6.8 p -148.11 162.79 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.577 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.487 ' O ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -138.38 126.09 22.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.261 -0.899 . . . . 0.0 110.178 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.506 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.0 pp -172.85 173.81 3.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.165 -0.96 . . . . 0.0 110.0 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.53 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.6 OUTLIER -107.19 154.52 21.08 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.22 -0.925 . . . . 0.0 108.739 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.74 157.53 46.47 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.166 -0.959 . . . . 0.0 109.458 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.667 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 85.8 t80 -149.85 96.6 2.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.269 -0.895 . . . . 0.0 109.27 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.5 158.12 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.253 -0.904 . . . . 0.0 109.305 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -84.39 127.25 33.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.194 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -104.22 155.93 18.32 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 109.761 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.8 m -79.78 143.35 34.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.355 -0.841 . . . . 0.0 109.108 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.8 m -110.1 54.51 0.66 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.457 -0.777 . . . . 0.0 109.362 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.594 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 94.95 103.1 1.85 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.421 ' C ' ' O ' ' A' ' 67' ' ' GLY . 0.2 OUTLIER -43.14 91.46 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.206 -1.173 . . . . 0.0 109.331 -179.897 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.594 ' N ' ' O ' ' A' ' 67' ' ' GLY . . . -163.73 4.3 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.218 -0.926 . . . . 0.0 109.57 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.57 ' C ' ' H ' ' A' ' 72' ' ' LYS . 4.2 ttt 43.26 55.41 4.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.257 -0.902 . . . . 0.0 109.45 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.777 ' OG ' ' HG2' ' A' ' 73' ' ' ARG . 0.9 OUTLIER -71.08 30.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 0.0 109.514 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.57 ' H ' ' C ' ' A' ' 70' ' ' MET . 11.4 tttt 55.82 22.23 5.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.524 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.777 ' HG2' ' OG ' ' A' ' 71' ' ' SER . 11.2 ptm180 -173.02 126.48 0.45 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.577 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.94 -161.9 0.85 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.387 -0.821 . . . . 0.0 109.336 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.34 152.46 28.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.355 -0.84 . . . . 0.0 109.44 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.667 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 1.7 m-85 -134.17 126.46 29.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.411 -0.806 . . . . 0.0 109.683 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.64 159.32 43.0 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.794 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.8 tt -113.08 155.84 24.19 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.0 mt -138.06 135.68 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.915 -1.116 . . . . 0.0 109.121 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.3 m -95.93 120.24 35.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.565 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 64.9 t-105 -92.86 111.32 22.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.028 -1.045 . . . . 0.0 109.878 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -107.52 92.88 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.64 147.36 48.15 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.19 -14.1 60.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.31 -1.112 . . . . 0.0 109.582 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.59 37.02 1.41 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 109.492 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.79 160.47 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.0 m -91.64 -170.29 2.55 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.373 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -18.1 64.07 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 90' ' ' GLN . 8.0 mt -51.08 -69.79 0.1 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.15 -1.206 . . . . 0.0 109.5 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.552 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 0.9 OUTLIER -44.61 -33.94 1.98 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 109.292 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.417 ' HA ' ' HE ' ' A' ' 91' ' ' ARG . 1.1 tpm_? -45.62 -61.69 1.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.693 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.7 -37.24 42.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.193 -0.942 . . . . 0.0 109.487 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.584 ' C ' ' HH ' ' A' ' 31' ' ' TYR . 0.1 OUTLIER -64.75 -66.31 0.56 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.943 . . . . 0.0 109.834 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.607 ' N ' ' HH ' ' A' ' 31' ' ' TYR . 95.6 m -44.74 -40.68 6.22 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.25 -0.906 . . . . 0.0 109.562 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.489 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -51.12 -57.22 11.68 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 35.0 p -67.92 -47.99 67.2 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.957 -1.32 . . . . 0.0 110.909 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.54 ' OD2' ' CD1' ' A' ' 36' ' ' ILE . 9.6 t0 -69.66 -45.37 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.816 -1.177 . . . . 0.0 111.03 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.499 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -55.38 -24.26 28.87 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.774 -1.17 . . . . 0.0 108.604 -179.734 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.3 OUTLIER -67.23 -50.24 61.43 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.338 -0.851 . . . . 0.0 108.79 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 10.4 mp -51.33 -54.67 24.01 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.292 -0.88 . . . . 0.0 109.499 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.405 ' O ' ' C ' ' A' ' 102' ' ' LYS . 31.2 t -48.94 -74.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.148 -0.97 . . . . 0.0 109.945 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 101' ' ' VAL . 32.8 mtmt -43.13 -48.96 6.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.152 -0.968 . . . . 0.0 109.681 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 105' ' ' VAL . 46.6 mt-10 -57.58 -57.37 12.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.921 . . . . 0.0 110.045 -179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.504 ' CG1' ' O ' ' A' ' 104' ' ' VAL . 97.5 t -75.56 40.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 109.911 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' A' ' 103' ' ' GLU . 2.2 t -138.23 113.04 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.098 -1.001 . . . . 0.0 109.863 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.621 ' O ' ' N ' ' A' ' 108' ' ' PHE . 1.0 OUTLIER -124.2 -30.24 3.47 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 9.3 m-20 -61.21 35.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.822 -0.549 . . . . 0.0 110.214 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.621 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -149.71 -178.06 6.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.066 -1.021 . . . . 0.0 110.135 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.96 -62.76 1.29 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.414 -0.804 . . . . 0.0 109.925 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.534 ' NZ ' ' CB ' ' A' ' 110' ' ' LYS . 5.6 ttpm? -147.4 173.9 12.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.22 -0.925 . . . . 0.0 109.6 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.491 ' H ' ' CG ' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -104.62 155.43 18.85 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.932 . . . . 0.0 109.192 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -135.43 150.67 49.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.272 -0.893 . . . . 0.0 110.069 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.8 p -116.29 147.26 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.428 HG23 HD13 ' A' ' 114' ' ' ILE . 27.5 mm -138.5 156.56 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.188 -0.945 . . . . 0.0 110.375 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.403 ' O ' ' OG ' ' A' ' 115' ' ' SER . 0.3 OUTLIER -140.75 6.03 2.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.579 ' OD1' ' N ' ' A' ' 117' ' ' ARG . 43.3 t0 -150.14 155.36 39.67 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.866 . . . . 0.0 109.409 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.579 ' N ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -79.04 -28.39 43.23 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.197 -0.939 . . . . 0.0 110.047 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -73.99 -14.74 61.07 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.603 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -86.41 4.63 38.67 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -0.821 . . . . 0.0 109.744 -179.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.419 ' O ' ' OH ' ' A' ' 45' ' ' TYR . 7.2 mt -114.12 29.48 7.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.362 -0.837 . . . . 0.0 109.652 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 124' ' ' PHE . 4.0 mm-40 -76.83 141.83 40.51 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.351 -0.843 . . . . 0.0 109.287 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 121' ' ' GLU . 1.3 mt-10 -41.31 -52.4 3.46 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.187 -0.945 . . . . 0.0 109.742 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.2 -10.88 45.81 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.307 -0.87 . . . . 0.0 110.868 -179.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.603 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 18.0 t80 -86.34 -48.81 8.15 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.737 -1.227 . . . . 0.0 109.359 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -76.24 -20.56 15.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.402 HH21 ' HA2' ' A' ' 67' ' ' GLY . 61.7 ttt180 -73.34 -53.35 10.99 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.27 -0.894 . . . . 0.0 108.951 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.65 -18.66 65.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.315 -0.866 . . . . 0.0 109.315 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.404 ' CG ' ' O ' ' A' ' 124' ' ' PHE . 5.7 mm-40 -72.36 -43.09 64.53 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.191 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.599 ' C ' ' H ' ' A' ' 131' ' ' LYS . 9.1 mt -66.51 -36.39 82.59 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -55.39 -4.67 0.1 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.599 ' H ' ' C ' ' A' ' 129' ' ' LEU . 12.8 ttpt 61.37 104.45 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 CA-C-O 121.72 0.771 . . . . 0.0 109.395 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -159.96 31.11 0.18 Allowed 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.61 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -141.27 -68.99 0.03 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 75.4 138.14 0.63 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.454 ' O ' ' O ' ' A' ' 136' ' ' ASN . . . -145.27 68.9 1.23 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.235 -1.156 . . . . 0.0 109.476 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.601 ' N ' ' ND2' ' A' ' 136' ' ' ASN . 0.3 OUTLIER 49.31 96.95 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.237 -0.915 . . . . 0.0 109.454 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -140.8 -35.81 0.48 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.323 -0.861 . . . . 0.0 109.438 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -143.6 40.65 1.43 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.297 -0.877 . . . . 0.0 109.45 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -149.86 37.56 0.72 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.295 -0.878 . . . . 0.0 109.453 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -69.79 101.17 1.65 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.238 -0.914 . . . . 0.0 109.45 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.67 -12.61 60.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.279 -0.888 . . . . 0.0 109.473 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.437 179.978 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.513 ' O ' ' CB ' ' A' ' 2' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.513 ' CB ' ' O ' ' A' ' 1' ' ' MET . . . 76.05 159.32 0.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.419 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m -158.02 147.57 19.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.21 -0.932 . . . . 0.0 109.457 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.641 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.666 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.578 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.775 HD21 HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -79.65 -7.96 58.9 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.575 ' C ' ' H ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -92.34 158.09 16.28 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.24 -0.913 . . . . 0.0 109.444 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.69 38.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.202 -0.936 . . . . 0.0 109.815 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.575 ' H ' ' C ' ' A' ' 19' ' ' ASP . . . 174.35 -91.77 0.09 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.556 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 0.7 OUTLIER 74.15 -55.11 0.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -1.064 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.556 ' CB ' ' O ' ' A' ' 22' ' ' SER . . . 84.16 52.82 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.541 ' O ' ' CG1' ' A' ' 17' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.448 ' C ' ' O ' ' A' ' 24' ' ' VAL . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.666 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.537 ' OH ' ' CG2' ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.429 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.544 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.464 ' CA ' ' CE2' ' A' ' 26' ' ' TRP . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.432 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.3 mm100 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 56' ' ' VAL . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.433 ' H ' ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.496 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.8 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.673 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER -109.82 77.29 1.04 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.1 130.36 4.24 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.737 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 0.0 OUTLIER -79.08 91.66 4.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -1.133 . . . . 0.0 109.481 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 71' ' ' SER . . . 164.83 132.08 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.23 -0.919 . . . . 0.0 109.445 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.652 ' HE2' ' C ' ' A' ' 70' ' ' MET . 6.3 tpt 54.88 -82.78 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.46 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.578 ' N ' ' O ' ' A' ' 69' ' ' ALA . 1.7 m 54.01 80.27 0.12 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.42 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -86.53 -11.39 51.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.235 -0.916 . . . . 0.0 109.56 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.8 mtt180 -159.33 96.27 1.29 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.248 -0.907 . . . . 0.0 109.634 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.8 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -50.45 -178.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.46 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.525 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.537 ' CG2' ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.409 ' OD2' ' CD1' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.439 ' CG2' ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.478 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.775 HD21 HD21 ' A' ' 15' ' ' ASN . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.59 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.582 ' C ' ' H ' ' A' ' 131' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.33 -7.73 0.26 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.582 ' H ' ' C ' ' A' ' 129' ' ' LEU . 7.3 ttpp 61.26 104.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.797 0.808 . . . . 0.0 109.338 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -139.25 -32.35 0.66 Allowed 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -47.33 162.43 0.26 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -137.58 167.15 24.88 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . -162.87 24.47 0.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -1.164 . . . . 0.0 109.501 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.552 ' N ' ' ND2' ' A' ' 136' ' ' ASN . 0.6 OUTLIER 65.94 -74.02 0.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 109.567 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.446 ' N ' ' O ' ' A' ' 135' ' ' ALA . 74.4 t80 53.05 6.74 0.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.276 -0.89 . . . . 0.0 109.438 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.53 ' H ' ' C ' ' A' ' 136' ' ' ASN . 12.6 t0 -165.29 -87.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -145.86 83.48 1.64 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.527 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 48.84 -99.52 0.06 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.241 -0.912 . . . . 0.0 109.432 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -173.36 4.06 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.911 . . . . 0.0 109.438 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.515 -179.982 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.0 mmt . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -158.37 -18.42 0.08 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.259 -0.901 . . . . 0.0 109.442 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.54 145.78 24.95 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.335 -0.853 . . . . 0.0 109.455 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -139.61 118.44 12.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.236 -0.915 . . . . 0.0 109.47 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.3 tt -113.84 147.21 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.522 -0.736 . . . . 0.0 109.653 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -94.37 63.0 2.97 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.218 -0.926 . . . . 0.0 109.111 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.68 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.49 -26.16 60.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 109.55 -179.705 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.87 -46.6 71.36 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.278 -0.889 . . . . 0.0 109.407 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -60.86 -68.12 0.34 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.947 . . . . 0.0 109.582 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.76 -58.9 2.79 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.164 -0.96 . . . . 0.0 109.859 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 8.5 ttt180 -44.41 -59.57 2.35 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.925 -1.109 . . . . 0.0 110.219 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.75 -37.0 65.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.937 . . . . 0.0 110.038 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -83.6 -19.17 36.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.096 -1.003 . . . . 0.0 110.117 -179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.505 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -72.62 -53.89 10.62 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.111 -0.993 . . . . 0.0 109.569 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.7 ' ND2' HD21 ' A' ' 107' ' ' ASN . 1.7 m-80 -68.51 -25.68 65.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.221 -0.924 . . . . 0.0 109.547 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.524 ' O ' ' CB ' ' A' ' 22' ' ' SER . 1.3 tp -57.64 -61.33 2.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.233 -0.917 . . . . 0.0 109.329 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 21.4 m -51.84 -19.41 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 109.733 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.476 HH11 ' HZ2' ' A' ' 72' ' ' LYS . 8.0 ttm180 -56.19 -31.22 63.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.169 -0.957 . . . . 0.0 109.507 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -75.1 160.27 30.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.571 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -63.92 60.43 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.308 -0.87 . . . . 0.0 109.614 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.588 ' O ' ' N ' ' A' ' 23' ' ' ALA . . . 133.59 -73.56 0.45 Allowed Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.543 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 0.6 OUTLIER 54.31 -82.12 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.531 -0.982 . . . . 0.0 109.457 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.588 ' N ' ' O ' ' A' ' 21' ' ' GLY . . . 161.12 -172.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.509 -0.744 . . . . 0.0 109.389 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.494 ' C ' ' O ' ' A' ' 23' ' ' ALA . 4.8 m 31.94 74.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.846 -0.534 . . . . 0.0 110.686 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.448 ' C ' ' O ' ' A' ' 24' ' ' VAL . 6.3 tt -44.49 -38.4 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.089 -1.007 . . . . 0.0 108.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.618 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 43.5 p-90 -150.57 162.51 40.5 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.397 -0.814 . . . . 0.0 109.25 178.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.8 m -133.26 139.4 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 109.187 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.7 p -128.98 139.93 51.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.34 -0.85 . . . . 0.0 110.179 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.18 133.36 51.58 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 16.9 ptt180 -108.59 147.41 31.85 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.852 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.545 ' HH ' ' CG ' ' A' ' 97' ' ' ASP . 14.5 m-85 -47.55 98.66 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.565 -0.709 . . . . 0.0 109.766 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -96.02 101.97 13.7 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.7 -120.23 21.47 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.99 22.25 16.23 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.326 -1.103 . . . . 0.0 110.228 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.0 m -145.33 136.99 25.35 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.581 ' CD1' ' N ' ' A' ' 36' ' ' ILE . 1.9 mp -81.62 114.35 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.221 -0.924 . . . . 0.0 108.979 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -135.46 152.0 75.7 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 109.717 -179.56 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 97.0 Cg_exo -33.12 145.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 122.971 2.447 . . . . 0.0 112.252 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -137.44 -36.45 0.17 Allowed Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.626 ' CG ' HE22 ' A' ' 51' ' ' GLN . 2.7 m-20 -142.67 -179.81 6.54 Favored 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.731 -0.864 . . . . 0.0 109.419 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.825 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -157.03 179.8 8.94 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.995 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.27 133.09 2.89 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.45 -3.04 24.52 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.82 175.97 12.92 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -42.42 70.55 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 120.677 -1.264 . . . . 0.0 108.946 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.489 ' NE2' ' N ' ' A' ' 46' ' ' GLN . 0.7 OUTLIER -43.09 -35.54 1.34 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.305 -0.872 . . . . 0.0 110.674 -179.328 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.536 ' CE1' ' OE1' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -62.95 -22.56 66.88 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.013 -1.054 . . . . 0.0 109.532 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.553 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -68.44 -23.97 64.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.202 -0.936 . . . . 0.0 108.718 179.489 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.551 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.4 mt -76.57 -54.02 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.582 -0.699 . . . . 0.0 109.927 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.455 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -65.56 -2.94 3.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 179.413 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.626 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.1 mm100 -106.13 -37.54 6.56 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.11 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.466 ' O ' ' CG2' ' A' ' 53' ' ' THR . 0.1 OUTLIER -49.32 132.43 20.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.287 -0.883 . . . . 0.0 109.644 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.574 ' C ' ' H ' ' A' ' 55' ' ' ASP . 20.6 p -160.07 115.29 2.34 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.4 -0.813 . . . . 0.0 110.555 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.74 11.36 0.1 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.628 -0.67 . . . . 0.0 109.587 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.574 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -122.71 16.68 10.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.495 -0.753 . . . . 0.0 109.324 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.532 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -135.72 154.26 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.4 -0.813 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.717 ' H ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.59 131.73 43.52 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.355 -0.841 . . . . 0.0 109.519 -179.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.502 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.8 pp -172.69 172.39 4.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.974 -1.078 . . . . 0.0 110.317 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.567 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 2.2 m-85 -106.01 153.96 21.29 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -135.83 156.9 48.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.02 -1.05 . . . . 0.0 109.556 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 53.9 t80 -148.19 97.57 2.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.358 -0.839 . . . . 0.0 109.21 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.503 ' O ' ' CE1' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -115.74 150.97 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -80.47 108.6 14.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.276 -0.89 . . . . 0.0 108.96 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CE1' ' O ' ' A' ' 62' ' ' VAL . 14.9 m-85 -86.72 155.76 20.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.324 -0.86 . . . . 0.0 109.805 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.55 161.04 28.19 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.298 -0.876 . . . . 0.0 108.848 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.9 t -109.75 43.8 1.28 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 0.0 109.466 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.676 ' N ' ' NZ ' ' A' ' 130' ' ' LYS . . . 84.61 -69.49 3.32 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -137.43 80.98 1.84 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.286 -1.126 . . . . 0.0 109.489 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.89 159.0 0.19 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.241 -0.912 . . . . 0.0 109.482 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.724 ' O ' ' OG ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -138.21 1.78 2.25 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.267 -0.896 . . . . 0.0 109.434 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.724 ' OG ' ' O ' ' A' ' 70' ' ' MET . 4.8 m 163.04 -110.52 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.334 -0.854 . . . . 0.0 109.461 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.476 ' HZ2' HH11 ' A' ' 18' ' ' ARG . 20.7 tttt -103.32 80.57 1.84 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.243 -0.91 . . . . 0.0 109.451 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 -138.75 -91.13 0.2 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.309 -0.87 . . . . 0.0 109.478 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.27 167.07 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.2 -0.938 . . . . 0.0 109.438 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.579 ' NZ ' ' O ' ' A' ' 129' ' ' LEU . 2.6 mmtp -104.59 154.98 19.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.846 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.582 ' O ' ' N ' ' A' ' 109' ' ' ALA . 84.3 m-85 -133.22 118.8 19.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.151 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.36 167.18 23.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.139 -0.976 . . . . 0.0 111.024 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.417 ' HG ' ' N ' ' A' ' 79' ' ' ILE . 9.2 tp -111.87 151.64 28.87 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.417 ' N ' ' HG ' ' A' ' 78' ' ' LEU . 22.1 mt -130.35 129.54 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.99 -1.069 . . . . 0.0 108.758 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.7 m -95.86 115.05 26.86 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.532 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 62.8 t-105 -92.97 111.23 22.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.101 -0.999 . . . . 0.0 109.651 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.9 mm -104.1 93.19 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 108.906 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.59 137.6 39.7 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -79.55 53.22 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.286 -1.126 . . . . 0.0 109.653 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -141.22 -30.99 0.6 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.17 -0.956 . . . . 0.0 109.81 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.433 ' CG2' ' NE2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -64.83 156.81 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.188 -0.945 . . . . 0.0 109.623 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.453 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 54.9 p -96.04 -127.89 0.14 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.363 -0.836 . . . . 0.0 109.587 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.453 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.17 -18.33 63.01 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.53 ' O ' ' CG ' ' A' ' 93' ' ' LYS . 3.4 mt -46.14 -48.9 17.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.971 -1.311 . . . . 0.0 109.934 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.433 ' NE2' ' CG2' ' A' ' 86' ' ' VAL . 3.1 pt20 -66.03 -26.39 67.49 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.145 -0.972 . . . . 0.0 109.908 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -56.39 -67.2 0.32 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.966 -1.084 . . . . 0.0 110.188 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.77 -44.43 49.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.18 -0.95 . . . . 0.0 110.131 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 89' ' ' LEU . 12.3 mmtm -55.82 -65.19 0.64 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.208 -0.933 . . . . 0.0 110.102 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 8.0 m -50.78 -49.68 57.75 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.131 -0.981 . . . . 0.0 109.679 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -46.94 -61.1 4.58 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 m -63.91 -51.12 65.94 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.031 -1.276 . . . . 0.0 111.78 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -74.57 -39.76 62.07 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.725 -1.234 . . . . 0.0 111.784 -177.183 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.588 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -55.36 -26.36 40.65 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 120.585 -1.322 . . . . 0.0 108.642 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.405 ' H ' ' HG1' ' A' ' 99' ' ' THR . 1.0 OUTLIER -78.45 -30.34 47.42 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.425 ' O ' ' C ' ' A' ' 101' ' ' VAL . 2.0 mt -71.18 -64.57 0.89 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.439 -0.788 . . . . 0.0 109.339 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.529 ' CG1' ' N ' ' A' ' 102' ' ' LYS . 9.9 p -41.9 -45.46 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.209 -0.932 . . . . 0.0 110.008 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.529 ' N ' ' CG1' ' A' ' 101' ' ' VAL . 6.1 ttpt -65.99 -39.4 90.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.271 -0.893 . . . . 0.0 109.597 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.416 ' C ' ' H ' ' A' ' 105' ' ' VAL . 1.8 mt-10 -60.66 -51.27 70.11 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.251 -0.906 . . . . 0.0 110.156 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 40.2 t -77.64 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.099 -1.001 . . . . 0.0 109.954 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.416 ' H ' ' C ' ' A' ' 103' ' ' GLU . 1.7 p -112.57 136.55 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.338 -0.851 . . . . 0.0 109.513 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -145.65 24.67 1.36 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.373 -0.829 . . . . 0.0 108.928 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.7 HD21 ' ND2' ' A' ' 15' ' ' ASN . 2.8 t-20 -135.39 -25.32 1.33 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.432 -0.792 . . . . 0.0 110.141 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -76.86 171.1 15.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.388 -179.561 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -117.79 -31.74 5.04 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.761 ' HE2' ' CE1' ' A' ' 112' ' ' PHE . 3.2 ttpm? -162.46 152.05 15.89 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.507 -0.746 . . . . 0.0 109.16 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -104.43 155.45 18.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.127 -0.983 . . . . 0.0 109.088 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.761 ' CE1' ' HE2' ' A' ' 110' ' ' LYS . 9.4 m-85 -133.88 156.44 48.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.366 -0.834 . . . . 0.0 109.819 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.531 ' CG1' ' O ' ' A' ' 113' ' ' VAL . 13.0 p -113.44 97.41 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 30.4 mm -100.32 142.44 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.228 -0.92 . . . . 0.0 109.888 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.1 m -141.1 15.6 2.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.308 -0.87 . . . . 0.0 109.548 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.9 155.34 46.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.034 -1.041 . . . . 0.0 110.124 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -69.71 -36.25 75.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 109.709 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -76.3 -17.36 59.48 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -83.25 -15.84 48.71 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.44 30.95 4.62 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.723 ' C ' ' CD ' ' A' ' 121' ' ' GLU . 0.0 OUTLIER -74.54 -175.31 2.35 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.448 0.642 . . . . 0.0 110.367 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.476 ' C ' ' OE2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -84.06 -44.65 13.88 Favored 'General case' 0 C--N 1.295 -1.771 0 O-C-N 121.36 -0.838 . . . . 0.0 110.145 177.272 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -85.79 -44.89 12.11 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 114.884 1.438 . . . . 0.0 114.884 -175.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.691 ' H ' ' CG ' ' A' ' 121' ' ' GLU . 18.9 t80 -49.94 -40.79 44.79 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 119.874 -1.766 . . . . 0.0 108.93 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.565 ' H ' ' CD ' ' A' ' 121' ' ' GLU . 1.1 mm -78.21 -27.17 14.53 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.831 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -67.48 -45.66 75.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.981 -1.074 . . . . 0.0 109.719 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.534 ' O ' ' N ' ' A' ' 130' ' ' LYS . 0.8 OUTLIER -63.2 -66.51 0.53 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.488 ' CD ' ' CE2' ' A' ' 112' ' ' PHE . 24.0 pt-20 -41.97 -33.2 0.52 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.489 -0.757 . . . . 0.0 109.318 -178.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.579 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . 4.8 mt -79.08 -32.17 44.64 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.111 -0.993 . . . . 0.0 109.056 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.676 ' NZ ' ' N ' ' A' ' 67' ' ' GLY . 14.2 mttp -69.17 -32.11 71.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.261 -0.9 . . . . 0.0 108.951 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.521 ' O ' ' CB ' ' A' ' 132' ' ' ALA . 0.3 OUTLIER -53.08 -65.85 0.49 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.29 -0.881 . . . . 0.0 109.523 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.521 ' CB ' ' O ' ' A' ' 131' ' ' LYS . . . 76.97 -27.83 0.18 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.264 -0.897 . . . . 0.0 109.504 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.583 ' O ' ' N ' ' A' ' 135' ' ' ALA . . . 67.23 29.76 74.74 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.437 ' C ' ' O ' ' A' ' 133' ' ' GLY . . . 43.1 -91.84 0.01 OUTLIER Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.583 ' N ' ' O ' ' A' ' 133' ' ' GLY . . . -157.28 -60.91 0.09 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.295 -1.121 . . . . 0.0 109.528 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -143.45 -136.5 0.1 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.243 -0.911 . . . . 0.0 109.452 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.505 ' O ' ' CD2' ' A' ' 137' ' ' TYR . 58.5 t80 55.93 26.57 9.96 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.277 -0.889 . . . . 0.0 109.453 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 139' ' ' ALA . 16.8 p-10 -166.17 23.25 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.27 -0.894 . . . . 0.0 109.493 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.435 ' C ' ' O ' ' A' ' 138' ' ' ASP . . . -43.38 -60.43 1.72 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.315 -0.866 . . . . 0.0 109.544 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -145.44 93.47 2.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.23 -0.918 . . . . 0.0 109.531 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.5 t -147.05 1.91 0.77 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.243 -0.911 . . . . 0.0 109.494 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.458 -179.949 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.617 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.472 ' O ' ' O ' ' A' ' 3' ' ' THR . . . -93.68 117.19 29.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.171 -0.956 . . . . 0.0 109.41 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.472 ' O ' ' O ' ' A' ' 2' ' ' ALA . 0.2 OUTLIER 60.45 137.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.216 -0.928 . . . . 0.0 109.444 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -133.49 121.79 22.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.38 -0.825 . . . . 0.0 109.314 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.2 tp -107.44 136.18 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.408 -0.807 . . . . 0.0 109.747 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 8' ' ' GLU . 1.9 p-10 -97.84 41.84 1.11 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -0.891 . . . . 0.0 109.041 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.431 ' C ' ' O ' ' A' ' 6' ' ' ASP . 1.3 mmtm -42.01 -18.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.346 -0.846 . . . . 0.0 109.898 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.5 mt-10 -51.96 -35.65 46.83 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.201 -0.937 . . . . 0.0 109.484 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.411 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -75.81 -63.67 1.25 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.863 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.65 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.49 -57.96 3.26 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.09 -1.006 . . . . 0.0 109.888 -179.439 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.65 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -44.16 -59.58 2.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.997 -1.064 . . . . 0.0 110.001 -179.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.9 -37.22 71.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.128 -0.983 . . . . 0.0 109.632 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.13 -11.13 59.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.12 -0.988 . . . . 0.0 109.852 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.476 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -81.88 -51.85 7.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.11 -0.994 . . . . 0.0 109.734 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.579 ' ND2' ' O ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -77.72 -11.25 59.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.247 -0.908 . . . . 0.0 109.64 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.526 ' C ' ' H ' ' A' ' 18' ' ' ARG . 58.3 tp -78.41 -50.06 12.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.207 -0.933 . . . . 0.0 109.34 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.4 ' C ' ' H ' ' A' ' 19' ' ' ASP . 18.9 m -57.87 -2.87 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.306 -0.871 . . . . 0.0 109.484 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.526 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.51 17.41 0.87 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.593 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -103.5 146.84 27.92 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.338 -0.851 . . . . 0.0 109.491 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.487 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 12.5 p30 -62.27 68.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.318 -0.864 . . . . 0.0 109.624 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . 86.16 70.84 1.31 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.52 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -100.88 -61.8 1.32 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -1.109 . . . . 0.0 109.421 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.52 ' CB ' ' O ' ' A' ' 22' ' ' SER . . . 163.5 169.47 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.0 109.472 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.525 ' O ' ' CG1' ' A' ' 24' ' ' VAL . 55.7 t 53.02 57.16 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.269 -0.894 . . . . 0.0 109.482 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' A' ' 42' ' ' GLY . 6.9 tt -47.16 -36.45 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.906 -1.121 . . . . 0.0 108.865 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.615 ' CZ3' ' O ' ' A' ' 41' ' ' GLN . 57.9 p-90 -148.27 151.57 35.66 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.784 -1.197 . . . . 0.0 109.671 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.35 163.36 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.31 -0.869 . . . . 0.0 109.701 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.403 ' HG1' ' HB3' ' A' ' 40' ' ' ASP . 0.2 OUTLIER -145.47 129.37 17.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.177 -0.952 . . . . 0.0 110.482 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.97 119.66 27.21 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 25.0 ptt180 -101.73 144.83 29.94 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -48.44 98.55 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.532 -0.73 . . . . 0.0 109.753 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -92.67 101.95 14.36 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.95 -119.28 15.55 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.094 -1.603 . . . . 0.0 109.094 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.34 24.95 12.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.546 -0.973 . . . . 0.0 110.146 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.4 m -146.36 132.59 19.46 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.151 -0.968 . . . . 0.0 109.982 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.584 ' CD1' ' N ' ' A' ' 36' ' ' ILE . 1.5 mp -79.95 113.12 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.175 -0.953 . . . . 0.0 108.515 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.46 152.13 75.92 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.196 -0.94 . . . . 0.0 110.16 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_exo -34.78 141.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.903 2.402 . . . . 0.0 112.471 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.78 -37.88 0.28 Allowed Glycine 0 N--CA 1.488 2.167 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.403 ' HB3' ' HG1' ' A' ' 28' ' ' THR . 0.2 OUTLIER -143.54 -179.49 6.47 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.615 ' O ' ' CZ3' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -130.79 -165.32 1.54 Allowed 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 121.49 0.662 . . . . 0.0 109.92 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.539 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . -139.36 101.61 0.32 Allowed Glycine 0 C--N 1.299 -1.497 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.531 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -136.9 50.99 1.99 Allowed 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.531 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 3.6 m-20 155.63 106.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.68 ' OH ' ' HE1' ' A' ' 64' ' ' PHE . 23.0 t80 -53.78 -14.69 1.0 Allowed 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.403 ' N ' ' C ' ' A' ' 44' ' ' ASP . 43.5 mm-40 -85.15 -40.73 16.4 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.012 -1.055 . . . . 0.0 109.893 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.4 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -61.66 -37.15 82.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.872 . . . . 0.0 110.334 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.623 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -59.12 -47.68 84.37 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.849 -1.157 . . . . 0.0 108.468 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.53 ' N ' ' CG ' ' A' ' 48' ' ' PHE . 1.7 mt -47.09 -43.72 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.396 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.9 pp0? -85.77 -10.06 56.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.95 -1.094 . . . . 0.0 110.481 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -86.95 8.15 24.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.96 -1.088 . . . . 0.0 109.771 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.581 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 4.8 p -130.7 55.09 1.85 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.341 -0.849 . . . . 0.0 109.477 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.588 ' C ' ' H ' ' A' ' 55' ' ' ASP . 9.5 p -73.45 159.48 33.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -0.945 . . . . 0.0 109.854 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.17 8.72 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.835 . . . . 0.0 110.156 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.588 ' H ' ' C ' ' A' ' 53' ' ' THR . 44.4 m-20 -116.84 21.8 13.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 109.57 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.524 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.2 OUTLIER -144.7 157.69 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.209 -0.932 . . . . 0.0 109.772 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.655 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -136.23 116.44 13.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.403 -0.81 . . . . 0.0 109.225 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.537 ' CD2' ' C ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -159.68 175.47 13.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.961 -1.087 . . . . 0.0 111.125 -179.357 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.56 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 3.5 m-85 -109.84 151.4 27.07 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -134.37 154.61 51.26 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.896 -1.128 . . . . 0.0 109.349 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.442 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 47.3 t80 -148.8 99.14 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.076 -1.015 . . . . 0.0 108.926 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -118.86 152.66 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.382 -0.824 . . . . 0.0 108.976 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.46 HH11 ' HG3' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -84.47 123.37 30.19 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.403 -0.811 . . . . 0.0 109.053 179.461 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.68 ' HE1' ' OH ' ' A' ' 45' ' ' TYR . 94.1 m-85 -108.14 156.23 19.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.415 -0.803 . . . . 0.0 109.356 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 98.2 m -78.49 161.01 27.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.153 -0.967 . . . . 0.0 109.12 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.459 ' O ' ' O ' ' A' ' 67' ' ' GLY . 13.6 t -109.92 159.81 16.93 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.383 -0.823 . . . . 0.0 109.454 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.459 ' O ' ' O ' ' A' ' 66' ' ' THR . . . -51.46 -100.29 0.01 OUTLIER Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -138.1 43.18 2.22 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -1.145 . . . . 0.0 109.453 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -101.25 129.76 47.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.921 . . . . 0.0 109.456 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.458 ' SD ' ' N ' ' A' ' 70' ' ' MET . 2.2 mpt? -71.39 -34.38 70.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.933 . . . . 0.0 109.459 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.5 t -73.03 161.05 31.13 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.206 -0.934 . . . . 0.0 109.439 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' A' ' 73' ' ' ARG . 8.1 mmtp 53.45 51.21 15.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.212 -0.93 . . . . 0.0 109.479 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.492 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.9 tpt180 -43.7 130.75 5.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.252 -0.905 . . . . 0.0 109.417 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 73' ' ' ARG . 0.4 OUTLIER 57.71 154.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.225 -0.922 . . . . 0.0 109.448 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.414 ' HD2' HD13 ' A' ' 129' ' ' LEU . 5.0 mmtm -105.86 143.62 33.75 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.325 -0.859 . . . . 0.0 109.71 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.445 ' O ' ' N ' ' A' ' 109' ' ' ALA . 90.9 m-85 -133.53 117.74 17.48 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.362 -0.836 . . . . 0.0 109.121 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.531 ' CB ' ' O ' ' A' ' 110' ' ' LYS . . . -144.38 167.74 21.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.018 -1.051 . . . . 0.0 111.3 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.1 tp -114.16 156.48 24.16 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.6 mt -136.23 130.85 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.101 -0.999 . . . . 0.0 108.924 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.84 114.58 26.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.186 -0.946 . . . . 0.0 109.84 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.581 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 65.5 t-105 -93.35 112.38 24.28 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.579 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.81 93.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -48.21 156.39 1.12 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.54 -7.39 38.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -1.14 . . . . 0.0 109.698 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -102.9 21.11 16.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.227 -0.921 . . . . 0.0 109.583 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.671 ' CG1' ' H ' ' A' ' 87' ' ' SER . 4.8 t -86.28 -141.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.255 -0.903 . . . . 0.0 109.467 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.671 ' H ' ' CG1' ' A' ' 86' ' ' VAL . 10.0 m -150.27 -146.45 0.2 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.164 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.468 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -83.92 -17.28 65.76 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 90' ' ' GLN . 6.1 mp -46.5 -69.88 0.12 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.178 -1.189 . . . . 0.0 109.802 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.576 ' OE1' ' N ' ' A' ' 90' ' ' GLN . 3.3 mp0 -44.55 -29.65 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.121 -0.987 . . . . 0.0 109.229 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.468 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER -54.37 -64.5 0.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.12 -0.987 . . . . 0.0 109.737 -179.659 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 -44.11 38.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.161 -0.962 . . . . 0.0 109.707 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.35 -65.95 0.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.227 -0.921 . . . . 0.0 110.069 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.406 ' CB ' ' O ' ' A' ' 90' ' ' GLN . 2.1 m -51.86 -54.44 29.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.155 -0.966 . . . . 0.0 109.216 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.41 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.96 -62.84 2.5 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 p -64.58 -50.32 67.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.184 -1.186 . . . . 0.0 111.164 -178.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.412 ' OD2' ' CG2' ' A' ' 3' ' ' THR . 2.9 m-20 -66.46 -40.2 89.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.782 -1.199 . . . . 0.0 111.693 -177.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.62 -24.52 65.57 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 120.628 -1.295 . . . . 0.0 109.119 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -77.69 -39.42 44.82 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' A' ' 101' ' ' VAL . 11.6 mt -64.38 -61.46 2.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.404 -0.81 . . . . 0.0 109.044 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.452 ' C ' ' O ' ' A' ' 100' ' ' LEU . 42.7 t -38.88 -55.83 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 110.262 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 103' ' ' GLU . 76.9 tttt -65.39 -43.56 90.28 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.105 -0.997 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.425 ' C ' ' O ' ' A' ' 102' ' ' LYS . 1.4 tt0 -36.58 -33.64 0.05 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.487 -0.758 . . . . 0.0 111.293 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.494 ' CG2' ' O ' ' A' ' 104' ' ' VAL . 10.9 p -127.51 34.91 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.107 -0.996 . . . . 0.0 110.839 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.509 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 0.6 OUTLIER -115.07 119.9 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.93 . . . . 0.0 109.018 179.063 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.04 -27.58 1.82 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.248 -0.908 . . . . 0.0 109.388 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -51.89 -34.51 41.57 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.301 -0.874 . . . . 0.0 109.289 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -176.49 1.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.156 -0.965 . . . . 0.0 109.782 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.445 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -125.01 -29.41 3.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.521 -0.737 . . . . 0.0 109.235 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.531 ' O ' ' CB ' ' A' ' 77' ' ' ALA . 0.2 OUTLIER -159.16 140.69 13.19 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.0 109.348 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.562 ' H ' ' CD ' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -105.01 151.12 24.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.27 -0.894 . . . . 0.0 109.14 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -136.03 157.08 47.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.283 -0.886 . . . . 0.0 110.249 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.4 104.37 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 38.5 mm -97.83 151.43 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.184 -0.947 . . . . 0.0 109.816 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.54 5.51 2.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.351 -0.843 . . . . 0.0 109.257 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -135.21 154.58 51.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.578 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -69.52 -42.37 74.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 109.739 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -75.59 -4.18 38.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.153 -0.967 . . . . 0.0 109.294 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.588 ' OE2' ' CE1' ' A' ' 124' ' ' PHE . 9.9 mm-40 -86.4 0.54 53.84 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.248 -0.907 . . . . 0.0 109.618 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.1 mt -104.84 14.58 29.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.278 -0.889 . . . . 0.0 109.041 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -68.71 140.48 55.4 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.496 -0.752 . . . . 0.0 109.675 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.452 ' O ' ' N ' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -53.37 -53.02 57.18 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.875 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.78 69.24 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.173 -0.955 . . . . 0.0 109.692 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CE1' ' OE2' ' A' ' 119' ' ' GLU . 78.8 t80 -63.15 -47.71 81.55 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 122.008 0.909 . . . . 0.0 108.977 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.3 mm -74.4 -23.59 18.33 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 122' ' ' GLU . 13.9 ttm180 -65.58 -55.52 17.2 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.341 -0.85 . . . . 0.0 109.504 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -23.22 65.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.974 ' HG3' ' HA3' ' A' ' 133' ' ' GLY . 0.3 OUTLIER -85.14 -39.75 17.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.414 HD13 ' HD2' ' A' ' 75' ' ' LYS . 2.8 mt -69.86 -24.1 63.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.27 -0.894 . . . . 0.0 108.923 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -49.57 -35.71 21.45 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.281 -0.887 . . . . 0.0 108.678 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.587 ' HG2' ' N ' ' A' ' 132' ' ' ALA . 10.1 tttm -164.62 -80.79 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.459 -0.776 . . . . 0.0 109.645 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.587 ' N ' ' HG2' ' A' ' 131' ' ' LYS . . . -115.68 -79.61 0.59 Allowed 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.703 -0.623 . . . . 0.0 109.587 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.974 ' HA3' ' HG3' ' A' ' 128' ' ' GLU . . . 107.81 48.22 0.91 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.446 -1.461 . . . . 0.0 109.446 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 174.68 0.47 0.03 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . 53.26 -120.51 1.71 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -1.138 . . . . 0.0 109.405 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.557 ' C ' ' H ' ' A' ' 138' ' ' ASP . 2.6 p30 -73.68 -128.39 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.24 -0.913 . . . . 0.0 109.491 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.519 ' H ' ' CG ' ' A' ' 136' ' ' ASN . 12.7 t80 65.34 -41.36 0.32 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.0 109.544 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.557 ' H ' ' C ' ' A' ' 136' ' ' ASN . 8.4 t0 -74.82 -18.28 60.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.169 -0.957 . . . . 0.0 109.487 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -142.5 92.31 2.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.272 -0.893 . . . . 0.0 109.454 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -85.43 61.06 6.62 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.488 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 7.6 t -92.96 5.48 51.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.242 -0.911 . . . . 0.0 109.52 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 117.959 -1.019 . . . . 0.0 109.47 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.451 ' H1 ' ' H ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.482 ' C ' ' HG1' ' A' ' 3' ' ' THR . . . -79.19 156.53 28.15 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.32 -0.862 . . . . 0.0 109.488 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.482 ' HG1' ' C ' ' A' ' 2' ' ' ALA . 0.2 OUTLIER 70.54 144.99 0.06 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.297 -0.877 . . . . 0.0 109.471 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.63 129.34 36.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.391 -0.818 . . . . 0.0 109.452 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.3 tp -107.53 135.26 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.835 . . . . 0.0 109.692 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.538 ' O ' ' N ' ' A' ' 8' ' ' GLU . 83.8 m-20 -98.1 49.12 1.0 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.443 ' CE ' ' O ' ' A' ' 104' ' ' VAL . 0.1 OUTLIER -40.44 -24.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.459 -0.776 . . . . 0.0 109.804 -179.409 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -47.49 -39.31 15.68 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.148 -0.97 . . . . 0.0 109.046 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.75 3.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.329 -0.857 . . . . 0.0 109.399 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -52.34 -69.46 0.11 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.124 -0.985 . . . . 0.0 109.536 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.407 ' C ' ' O ' ' A' ' 10' ' ' CYS . 19.2 ttt180 -44.3 -57.64 3.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.858 -1.151 . . . . 0.0 109.378 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.6 -52.77 53.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -19.17 65.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.408 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.65 ' CE2' ' CE1' ' A' ' 61' ' ' PHE . 0.2 OUTLIER -73.72 -56.3 5.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.373 -0.829 . . . . 0.0 109.721 -179.497 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.681 HD21 HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -77.77 -17.88 57.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.332 -0.855 . . . . 0.0 109.918 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.03 -39.27 86.98 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.125 -0.984 . . . . 0.0 109.356 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.452 ' C ' ' H ' ' A' ' 19' ' ' ASP . 16.0 m -70.98 -4.57 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.182 -0.949 . . . . 0.0 109.511 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -69.6 5.61 1.37 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.24 -0.912 . . . . 0.0 109.404 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.452 ' H ' ' C ' ' A' ' 17' ' ' VAL . 9.4 t70 -91.65 -146.68 0.21 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.215 -0.928 . . . . 0.0 109.54 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -105.98 44.25 1.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.307 -0.871 . . . . 0.0 109.446 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 69.79 55.58 9.44 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.61 8.09 17.53 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.396 -1.061 . . . . 0.0 109.568 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.2 -128.81 0.14 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.36 -0.838 . . . . 0.0 109.73 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.551 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -105.67 119.09 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.407 -0.808 . . . . 0.0 109.554 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.445 HG21 ' H ' ' A' ' 26' ' ' TRP . 9.9 tt -48.26 -39.79 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.023 -1.048 . . . . 0.0 108.946 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.607 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 34.5 p-90 -156.24 150.68 25.67 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.872 -1.143 . . . . 0.0 110.371 178.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -116.05 152.39 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.445 -0.785 . . . . 0.0 109.479 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.536 ' O ' ' N ' ' A' ' 39' ' ' GLY . 5.9 p -129.76 135.56 48.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.442 -0.786 . . . . 0.0 110.035 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -124.15 119.15 28.59 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -100.34 147.79 25.41 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.634 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.589 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 12.3 m-85 -49.49 98.97 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.552 -0.718 . . . . 0.0 110.113 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.71 101.54 13.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.09 -121.0 23.39 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.22 22.09 16.43 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.392 -1.063 . . . . 0.0 110.081 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.0 m -142.72 132.36 23.88 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.28 -0.888 . . . . 0.0 110.042 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.5 mp -79.12 114.98 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.349 -0.844 . . . . 0.0 108.956 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -135.55 151.88 75.33 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.389 -0.819 . . . . 0.0 109.804 -179.322 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.412 ' C ' ' O ' ' A' ' 37' ' ' VAL . 90.3 Cg_exo -34.57 149.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.653 2.236 . . . . 0.0 111.744 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -136.53 -44.35 0.09 OUTLIER Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.573 ' CG ' HE22 ' A' ' 51' ' ' GLN . 0.7 OUTLIER -143.02 -178.86 6.04 Favored 'General case' 0 C--N 1.294 -1.808 0 O-C-N 121.672 -0.899 . . . . 0.0 109.157 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.613 ' NE2' ' CE1' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -144.85 -166.97 2.54 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.441 -0.787 . . . . 0.0 109.789 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -166.82 134.45 3.28 Favored Glycine 0 N--CA 1.487 2.051 0 N-CA-C 109.654 -1.379 . . . . 0.0 109.654 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.14 -5.55 19.27 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -158.2 176.11 12.91 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.505 ' CE2' ' CE2' ' A' ' 48' ' ' PHE . 1.6 t80 -73.79 -44.74 55.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.012 -1.055 . . . . 0.0 109.55 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 45' ' ' TYR . 21.7 mm-40 -42.29 -37.89 1.65 Allowed 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.263 -0.898 . . . . 0.0 110.274 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.613 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 3.5 t-160 -60.99 -43.67 98.51 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.061 -1.024 . . . . 0.0 109.781 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.619 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -49.47 -33.99 15.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.133 -0.979 . . . . 0.0 108.707 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.4 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.7 mt -64.36 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.419 -0.8 . . . . 0.0 111.203 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.554 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 2.6 tm0? -85.72 -13.63 47.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.658 -1.276 . . . . 0.0 107.951 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.573 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -96.52 -6.56 36.75 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.583 -178.692 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.57 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 16.8 p -123.37 54.08 1.29 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.416 -0.803 . . . . 0.0 110.317 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 55' ' ' ASP . 40.9 p -75.48 155.1 36.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.856 -1.152 . . . . 0.0 109.42 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 p30 -71.77 12.58 0.36 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.768 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.49 ' H ' ' C ' ' A' ' 53' ' ' THR . 13.0 t70 -97.67 -0.19 46.01 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.171 -0.955 . . . . 0.0 110.169 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.414 HG22 ' H ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.41 176.07 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 120.909 -1.119 . . . . 0.0 110.634 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.461 ' NE ' ' CG1' ' A' ' 86' ' ' VAL . 5.5 ptp180 -138.96 134.75 33.56 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.515 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.5 pp -168.6 172.34 8.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.369 -0.832 . . . . 0.0 109.172 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -105.44 152.73 22.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -0.981 . . . . 0.0 109.282 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -130.17 153.56 48.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.418 -0.801 . . . . 0.0 108.998 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.65 ' CE1' ' CE2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -136.78 107.76 6.7 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.395 -0.815 . . . . 0.0 109.038 -179.583 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.1 143.32 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.393 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -83.12 115.89 22.09 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -93.76 155.72 17.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.232 -0.917 . . . . 0.0 110.171 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.57 149.16 34.88 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.505 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 0.9 OUTLIER -109.63 6.34 23.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 109.547 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 150.77 135.27 2.34 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -79.69 70.56 6.21 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -1.17 . . . . 0.0 109.474 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -150.47 -92.06 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.448 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.575 ' C ' ' H ' ' A' ' 72' ' ' LYS . 2.8 mtt -75.12 -44.15 48.77 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.138 -0.976 . . . . 0.0 109.454 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.496 ' C ' ' H ' ' A' ' 73' ' ' ARG . 1.2 m 54.82 3.9 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.271 -0.893 . . . . 0.0 109.517 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.575 ' H ' ' C ' ' A' ' 70' ' ' MET . 71.0 mttt -73.1 15.7 0.2 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.245 -0.909 . . . . 0.0 109.482 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' CB ' ' A' ' 74' ' ' SER . 30.3 ttt180 -137.62 -62.33 0.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.283 -0.885 . . . . 0.0 109.395 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.51 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 0.5 OUTLIER 76.37 162.5 0.24 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.211 -0.931 . . . . 0.0 109.499 179.879 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HE2' ' HA ' ' A' ' 66' ' ' THR . 8.2 mttm -105.02 150.55 24.86 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.35 -0.844 . . . . 0.0 109.673 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.553 ' O ' ' N ' ' A' ' 109' ' ' ALA . 89.1 m-85 -133.36 117.81 17.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.44 -0.788 . . . . 0.0 109.119 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.71 165.14 28.49 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.973 -1.079 . . . . 0.0 111.456 -178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.446 HD11 ' H ' ' A' ' 79' ' ' ILE . 11.7 tp -108.89 145.72 34.91 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.446 ' H ' HD11 ' A' ' 78' ' ' LEU . 19.6 mt -131.33 141.44 45.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 120.85 -1.156 . . . . 0.0 108.846 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.0 m -112.62 124.83 53.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.063 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.564 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 60.8 t-105 -96.83 113.34 24.88 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.989 -1.069 . . . . 0.0 109.832 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mm -111.21 93.25 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -74.58 162.79 54.19 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 -179.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -110.46 66.97 0.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.627 -0.926 . . . . 0.0 109.689 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.448 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.2 t0 -169.41 -46.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.218 -0.926 . . . . 0.0 109.552 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.461 ' CG1' ' NE ' ' A' ' 57' ' ' ARG . 7.4 p -41.62 157.49 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.291 -0.881 . . . . 0.0 109.951 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 30.1 p -61.09 173.55 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.414 -0.804 . . . . 0.0 109.971 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.38 -21.49 56.49 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.63 -69.77 0.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.122 -1.222 . . . . 0.0 110.017 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 84.1 mm-40 -49.14 -22.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.81 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 1.7 ttp180 -55.85 -44.13 77.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.808 -1.183 . . . . 0.0 109.436 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.83 -35.66 62.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.234 -0.916 . . . . 0.0 109.894 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.408 ' O ' ' C ' ' A' ' 94' ' ' THR . 10.6 mmmt -74.71 -48.44 25.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -0.919 . . . . 0.0 109.358 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.589 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 35.3 m -45.2 -59.5 2.6 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.348 -0.845 . . . . 0.0 109.422 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.73 -59.99 4.03 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 p -63.21 -51.45 66.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.986 -1.302 . . . . 0.0 110.521 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -58.45 -45.87 87.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.016 -1.052 . . . . 0.0 110.631 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -51.22 -31.16 19.61 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.847 -1.158 . . . . 0.0 108.24 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.44 -41.18 96.79 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.0 mt -48.12 -57.97 5.13 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.578 ' C ' ' H ' ' A' ' 103' ' ' GLU . 4.5 t -56.47 -50.72 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -65.02 7.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.578 ' H ' ' C ' ' A' ' 101' ' ' VAL . 3.0 tt0 -99.77 -44.55 6.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -0.792 . . . . 0.0 109.368 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.527 ' CG1' ' O ' ' A' ' 104' ' ' VAL . 53.4 t -123.02 62.93 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.439 -0.788 . . . . 0.0 109.863 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.535 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 4.1 p -132.63 115.22 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.999 -1.063 . . . . 0.0 110.361 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.636 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -125.2 -36.54 2.5 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.181 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.681 HD21 HD21 ' A' ' 15' ' ' ASN . 8.3 m-20 -60.84 32.05 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.928 -0.482 . . . . 0.0 110.245 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.636 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -139.43 139.19 37.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 0.0 109.085 179.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -78.84 -35.58 43.78 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.172 -0.955 . . . . 0.0 109.41 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -162.65 157.72 22.24 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.27 -0.894 . . . . 0.0 109.456 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.73 156.45 17.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 108.922 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -139.14 154.92 48.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.136 -0.978 . . . . 0.0 110.104 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 6.7 p -119.5 157.76 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 2.4 mm -136.33 148.23 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.183 -0.948 . . . . 0.0 109.826 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.53 -3.92 2.97 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.548 ' O ' ' N ' ' A' ' 119' ' ' GLU . 0.1 OUTLIER -157.76 133.61 9.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.298 -0.876 . . . . 0.0 109.51 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.415 ' C ' ' O ' ' A' ' 116' ' ' ASP . 25.4 ttp180 -44.25 -25.37 0.23 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.254 -0.903 . . . . 0.0 109.625 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 116' ' ' ASP . 16.3 tttt -75.82 -18.56 59.43 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.174 -0.954 . . . . 0.0 109.359 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 59.4 mt-10 -86.28 -3.38 58.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.335 -0.853 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -105.27 31.41 4.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.176 -0.953 . . . . 0.0 108.866 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -83.04 155.1 24.09 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.509 -0.744 . . . . 0.0 109.783 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.15 -50.77 60.05 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.112 -0.993 . . . . 0.0 109.44 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.3 -15.3 9.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.891 . . . . 0.0 109.936 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.608 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 15.0 t80 -84.8 -49.28 8.57 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 0.0 109.184 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.547 ' CG2' HD12 ' A' ' 129' ' ' LEU . 3.0 mt -77.99 -11.88 13.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.802 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.14 -55.86 5.07 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.346 -0.846 . . . . 0.0 108.87 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -17.54 64.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.264 -0.897 . . . . 0.0 109.461 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.439 ' CA ' ' OE1' ' A' ' 128' ' ' GLU . 0.1 OUTLIER -84.74 -40.14 17.64 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.336 -0.852 . . . . 0.0 109.364 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.547 HD12 ' CG2' ' A' ' 125' ' ' ILE . 2.5 mt -79.24 -7.97 58.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.29 -0.881 . . . . 0.0 109.724 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.38 -11.4 46.3 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.05 -1.031 . . . . 0.0 108.942 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 132' ' ' ALA . 11.4 mttt -88.77 -64.11 1.19 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.403 -0.811 . . . . 0.0 109.404 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . 0.529 ' CB ' ' O ' ' A' ' 131' ' ' LYS . . . 76.96 -14.77 0.8 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.427 ' H ' ' C ' ' A' ' 131' ' ' LYS . . . 43.23 39.33 4.03 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 74.67 100.06 0.1 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.42 -52.45 18.47 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.325 -1.103 . . . . 0.0 109.511 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.465 HD21 ' H ' ' A' ' 136' ' ' ASN . 0.1 OUTLIER -142.78 13.85 1.91 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.494 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.44 ' O ' ' CD2' ' A' ' 137' ' ' TYR . 50.6 t80 -96.59 39.01 1.17 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.303 -0.873 . . . . 0.0 109.521 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -138.77 3.82 2.29 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.167 -0.958 . . . . 0.0 109.433 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.502 ' O ' ' NE2' ' A' ' 140' ' ' GLN . . . -100.73 -65.49 0.97 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.317 -0.864 . . . . 0.0 109.404 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 139' ' ' ALA . 62.4 mm-40 -139.91 -123.34 0.11 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.199 -0.938 . . . . 0.0 109.425 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.66 86.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 109.491 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 118.005 -0.998 . . . . 0.0 109.462 179.987 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ptt? . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.75 -5.65 51.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.24 -0.912 . . . . 0.0 109.459 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.09 134.69 38.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.229 -0.919 . . . . 0.0 109.477 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 mmtp -136.73 118.61 15.19 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.0 109.427 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -107.07 142.29 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.304 -0.873 . . . . 0.0 109.895 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.442 ' O ' ' C ' ' A' ' 7' ' ' LYS . 9.7 m-20 -90.25 44.5 1.2 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.301 -0.874 . . . . 0.0 108.974 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.674 ' HZ1' ' CB ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -38.68 -31.13 0.05 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.613 -0.679 . . . . 0.0 110.336 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' A' ' 6' ' ' ASP . 31.4 mt-10 -55.06 -51.22 67.03 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.22 -0.925 . . . . 0.0 110.307 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.96 -69.38 0.18 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.131 -0.981 . . . . 0.0 110.368 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -44.74 -57.89 3.42 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.218 -0.926 . . . . 0.0 110.465 -179.168 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.577 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 19.3 ttt180 -44.99 -58.54 3.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.93 -1.106 . . . . 0.0 110.266 -178.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.06 -46.42 82.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.218 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.39 -10.54 59.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.046 -1.034 . . . . 0.0 110.348 -179.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.5 m-85 -81.31 -54.2 5.68 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.709 HD21 HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -75.99 -14.41 60.23 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.188 -0.945 . . . . 0.0 109.461 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.558 ' C ' ' H ' ' A' ' 18' ' ' ARG . 5.2 tt -73.48 -51.48 16.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.379 -0.825 . . . . 0.0 109.474 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.582 ' O ' ' NH2' ' A' ' 63' ' ' ARG . 3.3 p -55.37 -4.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.206 -0.934 . . . . 0.0 109.524 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.558 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -82.57 -13.93 55.72 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.303 -0.873 . . . . 0.0 109.453 -179.819 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.487 ' O ' ' O ' ' A' ' 18' ' ' ARG . 4.3 p-10 -58.23 -151.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.33 -0.856 . . . . 0.0 109.649 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.92 43.98 1.1 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.232 -0.917 . . . . 0.0 109.314 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.41 56.97 5.81 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.474 ' N ' ' OD2' ' A' ' 19' ' ' ASP . 2.8 t -76.41 -42.18 45.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.22 -1.165 . . . . 0.0 109.384 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.464 ' CB ' ' O ' ' A' ' 22' ' ' SER . . . 166.96 -168.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.269 -0.894 . . . . 0.0 109.463 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.539 ' O ' ' CG1' ' A' ' 24' ' ' VAL . 75.7 t 47.24 52.28 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.162 -0.961 . . . . 0.0 109.365 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.44 ' N ' ' O ' ' A' ' 42' ' ' GLY . 12.8 tt -46.26 -29.78 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 120.824 -1.172 . . . . 0.0 108.575 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.619 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 32.2 p-90 -156.17 150.94 26.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.879 -1.138 . . . . 0.0 110.076 177.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.24 144.84 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.535 -0.728 . . . . 0.0 109.797 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.4 p -138.11 132.73 32.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.42 -0.8 . . . . 0.0 109.77 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.24 145.15 47.31 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.46 ' O ' ' N ' ' A' ' 32' ' ' ASP . 24.7 ptt180 -119.49 141.29 49.31 Favored 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 119.765 -0.774 . . . . 0.0 109.95 -178.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.47 ' HH ' ' C ' ' A' ' 93' ' ' LYS . 0.6 OUTLIER -41.28 98.44 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.718 -0.614 . . . . 0.0 109.783 -179.422 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -91.47 101.99 14.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.884 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 54.11 -116.51 6.31 Favored Glycine 0 N--CA 1.487 2.087 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.52 25.3 11.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.391 -1.064 . . . . 0.0 110.211 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.7 m -146.31 133.91 20.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.193 -0.942 . . . . 0.0 109.816 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.1 mp -81.72 111.98 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.031 -1.043 . . . . 0.0 108.73 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.45 152.49 76.6 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.347 -0.846 . . . . 0.0 109.977 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -39.16 140.44 0.48 Allowed 'Trans proline' 0 C--N 1.311 -1.409 0 C-N-CA 122.659 2.239 . . . . 0.0 112.249 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.18 -33.49 0.36 Allowed Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.509 ' CB ' HE22 ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.12 -177.93 5.59 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.644 ' NE2' ' HD1' ' A' ' 47' ' ' HIS . 0.3 OUTLIER -138.44 -176.94 4.64 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-O 121.821 0.82 . . . . 0.0 110.387 -179.826 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.44 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . -119.66 83.71 0.36 Allowed Glycine 0 N--CA 1.479 1.556 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.607 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -104.71 56.38 0.7 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.643 -0.916 . . . . 0.0 108.53 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.607 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 33.5 t0 120.21 140.84 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -179.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -56.86 -47.36 80.6 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.067 -1.021 . . . . 0.0 108.462 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -53.27 -34.87 59.05 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.345 -0.847 . . . . 0.0 109.416 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.644 ' HD1' ' NE2' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -53.21 -28.95 29.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.0 108.896 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.24 -34.98 75.66 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.5 mt -76.29 -13.97 14.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.222 -0.924 . . . . 0.0 109.553 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.525 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 26.4 tp60 -87.67 -50.41 6.51 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.105 -0.997 . . . . 0.0 109.411 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.509 HE22 ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -108.07 55.97 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.64 -0.662 . . . . 0.0 111.145 -178.183 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.1 t -162.32 62.66 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.082 -1.011 . . . . 0.0 109.184 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.583 ' O ' ' N ' ' A' ' 55' ' ' ASP . 2.5 p -87.54 154.68 20.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.404 -0.81 . . . . 0.0 109.916 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -46.14 -11.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.856 . . . . 0.0 109.652 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 53' ' ' THR . 1.9 t70 -93.27 35.37 1.09 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.202 -0.936 . . . . 0.0 109.403 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.581 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 53.3 t -145.4 145.3 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.282 -0.886 . . . . 0.0 109.45 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.638 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.51 122.98 27.08 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.48 -0.762 . . . . 0.0 109.68 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.594 ' O ' ' N ' ' A' ' 81' ' ' TRP . 4.1 pp -172.84 -170.93 0.71 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.934 -1.104 . . . . 0.0 110.718 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.623 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -118.32 153.61 33.69 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.213 -0.929 . . . . 0.0 109.145 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -136.31 156.35 48.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.791 -1.193 . . . . 0.0 109.309 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -149.56 103.35 3.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.16 -0.962 . . . . 0.0 109.375 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -118.37 154.37 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.241 -0.912 . . . . 0.0 109.602 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.582 ' NH2' ' O ' ' A' ' 17' ' ' VAL . 14.4 ttp180 -84.61 130.73 34.69 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -118.26 157.1 27.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.439 -0.788 . . . . 0.0 109.83 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.58 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . 8.7 t -97.0 140.96 30.75 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.314 -0.866 . . . . 0.0 109.044 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.58 ' O ' ' N ' ' A' ' 68' ' ' ASP . 0.2 OUTLIER -109.64 110.84 22.01 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.4 -0.813 . . . . 0.0 109.614 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.436 ' O ' ' CG ' ' A' ' 68' ' ' ASP . . . 57.28 -78.92 0.01 OUTLIER Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.58 ' N ' ' O ' ' A' ' 66' ' ' THR . 1.0 OUTLIER 176.72 -37.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.262 -1.14 . . . . 0.0 109.333 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.586 ' CB ' ' HB2' ' A' ' 73' ' ' ARG . . . 62.45 -174.9 0.14 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.273 -0.892 . . . . 0.0 109.486 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.79 ' SD ' ' O ' ' A' ' 70' ' ' MET . 1.8 tmm? -88.8 -28.05 20.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.867 . . . . 0.0 109.427 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.692 ' OG ' ' HE3' ' A' ' 70' ' ' MET . 19.9 m -135.23 -59.29 0.78 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.303 -0.873 . . . . 0.0 109.553 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.483 ' O ' ' CB ' ' A' ' 73' ' ' ARG . 16.4 mmtp -138.89 -93.58 0.18 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.229 -0.919 . . . . 0.0 109.528 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.586 ' HB2' ' CB ' ' A' ' 69' ' ' ALA . 0.1 OUTLIER 74.15 12.88 4.08 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.303 -0.873 . . . . 0.0 109.421 -179.911 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.419 ' C ' ' O ' ' A' ' 73' ' ' ARG . 25.0 p -42.56 151.2 0.12 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.271 -0.893 . . . . 0.0 109.459 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.58 ' NZ ' ' O ' ' A' ' 65' ' ' THR . 4.2 pttm -107.32 130.93 54.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.364 -0.835 . . . . 0.0 109.215 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.545 ' O ' ' N ' ' A' ' 109' ' ' ALA . 98.9 m-85 -103.82 129.3 51.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 110.275 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.57 161.95 37.82 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.126 -0.984 . . . . 0.0 111.241 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.8 157.44 25.56 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.9 mt -137.55 143.38 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 120.843 -1.161 . . . . 0.0 109.309 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.596 ' N ' ' O ' ' A' ' 112' ' ' PHE . 0.2 OUTLIER -100.82 114.83 28.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.162 -0.961 . . . . 0.0 109.03 179.636 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.597 ' CH2' ' O ' ' A' ' 115' ' ' SER . 73.5 t-105 -92.81 110.49 21.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.142 -0.973 . . . . 0.0 109.785 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.483 ' O ' ' OG ' ' A' ' 115' ' ' SER . 8.1 mm -114.88 92.5 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.03 161.09 0.05 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -88.36 -20.27 25.55 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -1.109 . . . . 0.0 109.457 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.49 41.46 1.23 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 109.505 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 52.0 t -96.83 161.98 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.228 -0.92 . . . . 0.0 109.732 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.9 t -95.32 -162.47 0.95 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.253 -0.904 . . . . 0.0 109.42 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.06 -18.12 63.69 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.5 mt -46.69 -60.86 2.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.912 -1.346 . . . . 0.0 109.79 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.45 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 22.3 mm-40 -56.8 -30.76 64.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.006 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -50.93 -62.32 1.68 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.924 -1.11 . . . . 0.0 109.916 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.99 -44.04 15.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.161 -0.962 . . . . 0.0 110.014 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.47 ' C ' ' HH ' ' A' ' 31' ' ' TYR . 21.3 mtpt -58.43 -58.93 6.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.207 -0.933 . . . . 0.0 110.007 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.442 ' OG1' ' CD ' ' A' ' 90' ' ' GLN . 2.1 m -57.19 -40.82 78.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.111 -0.993 . . . . 0.0 109.487 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -43.72 -59.61 3.67 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.164 -1.175 . . . . 0.0 110.164 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.569 ' HG1' ' N ' ' A' ' 97' ' ' ASP . 24.9 p -63.8 -42.88 97.63 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.072 -1.252 . . . . 0.0 110.845 -178.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.569 ' N ' ' HG1' ' A' ' 96' ' ' THR . 1.7 t0 -65.0 -44.18 90.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.852 -1.155 . . . . 0.0 111.192 -178.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -26.56 45.88 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.683 -1.261 . . . . 0.0 108.899 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -50.78 48.67 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.431 -0.793 . . . . 0.0 109.275 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.413 ' O ' ' C ' ' A' ' 101' ' ' VAL . 8.5 mp -57.3 -59.49 5.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.413 ' C ' ' O ' ' A' ' 100' ' ' LEU . 21.8 t -44.46 -69.18 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.847 . . . . 0.0 109.409 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 ttpp -48.61 -47.79 39.74 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.466 -0.771 . . . . 0.0 110.046 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.86 -31.55 71.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 111.013 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.7 p -106.28 13.71 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.096 -1.003 . . . . 0.0 110.747 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.493 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -108.39 124.43 64.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.102 -0.999 . . . . 0.0 109.829 179.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.671 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -126.51 -30.21 2.86 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 179.572 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.709 HD21 HD21 ' A' ' 15' ' ' ASN . 2.2 t-20 -62.39 29.27 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.537 -0.727 . . . . 0.0 109.93 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.671 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -141.95 160.85 39.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.153 -0.967 . . . . 0.0 109.238 179.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.545 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -95.66 -37.97 10.58 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.824 . . . . 0.0 109.609 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -158.29 159.83 36.38 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 109.438 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.75 160.48 14.94 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 109.172 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.596 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.9 m-85 -138.54 149.71 45.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.286 -0.884 . . . . 0.0 109.875 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 58.6 t -114.67 118.73 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.525 -0.734 . . . . 0.0 109.036 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.763 HG21 ' OE2' ' A' ' 119' ' ' GLU . 7.2 mt -138.55 158.62 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.0 110.289 -179.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.597 ' O ' ' CH2' ' A' ' 81' ' ' TRP . 11.2 t -134.1 -46.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.95 155.57 23.95 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.59 -0.694 . . . . 0.0 109.619 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -79.62 -17.82 52.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.107 -0.995 . . . . 0.0 109.841 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 60.4 tttt -73.51 -33.47 64.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.003 . . . . 0.0 109.832 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.763 ' OE2' HG21 ' A' ' 114' ' ' ILE . 0.3 OUTLIER -86.34 5.02 36.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.062 -1.024 . . . . 0.0 109.853 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 tt -104.26 0.45 29.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.166 -0.959 . . . . 0.0 109.188 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -49.5 139.36 12.22 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.428 -0.795 . . . . 0.0 109.798 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.1 OUTLIER -52.08 -53.81 37.89 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 109.878 -179.871 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . 0.401 ' OD1' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.01 -48.81 72.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.096 -1.002 . . . . 0.0 109.825 -179.265 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 65.9 t80 -48.48 -42.69 33.53 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 122.203 1.001 . . . . 0.0 109.073 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -76.11 -24.28 16.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.908 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.7 ttp180 -65.1 -55.71 17.18 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.238 -0.914 . . . . 0.0 109.107 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.0 t -62.52 -21.4 65.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -76.55 -41.74 45.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.436 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.607 ' C ' ' H ' ' A' ' 131' ' ' LYS . 16.3 mt -69.14 -38.7 78.96 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.154 -0.966 . . . . 0.0 108.56 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -54.33 -4.78 0.06 Allowed 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.153 -0.967 . . . . 0.0 108.567 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.607 ' H ' ' C ' ' A' ' 129' ' ' LEU . 6.9 tttp 60.9 102.25 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 CA-C-O 121.725 0.774 . . . . 0.0 109.421 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -149.51 41.62 0.88 Allowed 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 119.722 -0.791 . . . . 0.0 109.57 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.46 -36.94 8.39 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -100.53 121.99 7.43 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -147.75 67.52 1.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -1.121 . . . . 0.0 109.45 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.495 ' N ' ' OD1' ' A' ' 136' ' ' ASN . 0.0 OUTLIER -75.92 -49.0 19.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.297 -0.877 . . . . 0.0 109.461 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.497 ' CG ' ' O ' ' A' ' 137' ' ' TYR . 66.5 t80 52.07 23.72 2.38 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.332 -0.855 . . . . 0.0 109.474 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.452 ' CG ' ' N ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -167.54 -61.33 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.287 -0.883 . . . . 0.0 109.509 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.452 ' N ' ' CG ' ' A' ' 138' ' ' ASP . . . 174.28 122.66 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.278 -0.889 . . . . 0.0 109.48 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.452 ' O ' ' O ' ' A' ' 141' ' ' SER . 0.1 OUTLIER -84.39 118.84 24.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.254 -0.904 . . . . 0.0 109.521 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 142' ' ' GLU . 1.2 t 49.91 179.57 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.258 -0.901 . . . . 0.0 109.469 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.514 ' N ' ' OG ' ' A' ' 141' ' ' SER . 4.4 tt0 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.994 -1.003 . . . . 0.0 109.507 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.561 ' C ' ' H ' ' A' ' 3' ' ' THR . 9.1 mtm . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 52.85 6.01 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.286 -0.884 . . . . 0.0 109.452 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.561 ' H ' ' C ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -90.37 126.75 35.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.27 -0.894 . . . . 0.0 109.458 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -130.18 135.95 48.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.394 -0.816 . . . . 0.0 109.48 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.9 tp -118.46 130.28 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.47 -0.769 . . . . 0.0 109.335 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.504 ' O ' ' N ' ' A' ' 8' ' ' GLU . 5.6 m-20 -91.73 39.68 1.02 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.118 -0.989 . . . . 0.0 109.051 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.643 ' HZ3' ' CA ' ' A' ' 104' ' ' VAL . 3.5 mttt -42.43 -23.34 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.813 -179.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.567 ' OE1' ' N ' ' A' ' 8' ' ' GLU . 39.3 mp0 -50.11 -35.46 25.69 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.093 -1.005 . . . . 0.0 108.364 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.42 -46.02 13.01 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.57 ' O ' ' N ' ' A' ' 14' ' ' TYR . 13.0 t -60.67 -66.17 0.57 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.242 -0.911 . . . . 0.0 109.489 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.484 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 32.0 ttp180 -44.19 -56.24 4.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.756 -1.215 . . . . 0.0 109.882 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.13 -28.07 67.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.01 -1.056 . . . . 0.0 109.762 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -88.5 -58.22 2.63 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.073 -1.017 . . . . 0.0 109.605 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.661 ' CD1' ' CD1' ' A' ' 61' ' ' PHE . 5.9 t80 -45.16 -51.18 10.76 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.301 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.536 ' N ' ' ND2' ' A' ' 15' ' ' ASN . 0.3 OUTLIER -71.22 -45.04 64.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.023 -1.048 . . . . 0.0 110.248 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.554 ' C ' ' H ' ' A' ' 18' ' ' ARG . 20.6 tp -41.54 -48.64 3.98 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.076 -1.015 . . . . 0.0 110.063 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 1.2 m -53.85 -4.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.062 -1.024 . . . . 0.0 109.898 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.554 ' H ' ' C ' ' A' ' 16' ' ' LEU . 6.8 ttm180 -76.63 -17.13 59.34 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.149 -0.97 . . . . 0.0 109.285 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.486 ' O ' ' O ' ' A' ' 18' ' ' ARG . 22.2 t0 -58.0 -151.61 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.255 -0.903 . . . . 0.0 109.627 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.461 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 12.9 t70 -102.47 59.41 0.81 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.219 -0.926 . . . . 0.0 109.471 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 67.44 50.86 40.99 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.583 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 0.6 OUTLIER -72.54 -39.76 67.25 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.274 -1.133 . . . . 0.0 109.592 -179.805 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.583 ' CB ' ' O ' ' A' ' 22' ' ' SER . . . 158.15 -164.4 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.591 -0.693 . . . . 0.0 109.559 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.484 ' O ' ' CG2' ' A' ' 24' ' ' VAL . 4.6 p 35.39 57.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.676 -0.64 . . . . 0.0 110.458 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.468 HG21 ' H ' ' A' ' 26' ' ' TRP . 6.9 tt -42.92 -41.63 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.173 -0.954 . . . . 0.0 109.267 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.583 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 43.2 p-90 -149.25 166.78 27.89 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 120.992 -1.067 . . . . 0.0 110.261 178.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.402 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 18.3 m -137.68 141.81 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.891 . . . . 0.0 109.329 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.5 p -129.17 140.19 51.61 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 109.877 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.99 125.27 44.93 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -100.08 148.39 24.61 Favored 'General case' 0 C--N 1.296 -1.722 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.334 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.433 ' CD1' ' NE2' ' A' ' 90' ' ' GLN . 23.0 m-85 -57.87 98.7 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.558 -0.714 . . . . 0.0 109.779 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.61 102.07 13.47 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.28 -126.14 9.18 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.95 17.9 21.26 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.41 -1.053 . . . . 0.0 110.041 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.8 m -138.23 136.4 36.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.244 -0.91 . . . . 0.0 110.042 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.521 ' CD1' ' OD1' ' A' ' 97' ' ' ASP . 4.3 mp -79.78 115.36 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.38 150.83 73.56 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 109.937 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -34.56 152.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.376 0 C-N-CA 122.89 2.393 . . . . 0.0 112.324 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.29 -53.25 0.07 OUTLIER Glycine 0 N--CA 1.489 2.207 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.582 ' OD1' ' N ' ' A' ' 41' ' ' GLN . 14.1 t70 -143.28 179.53 7.03 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.713 -0.875 . . . . 0.0 108.976 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.583 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -140.98 -165.98 2.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 110.057 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.06 131.65 2.5 Favored Glycine 0 N--CA 1.486 1.969 0 N-CA-C 109.864 -1.295 . . . . 0.0 109.864 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.83 -5.06 21.51 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -148.3 164.84 32.81 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.56 ' C ' ' CD1' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -78.48 -11.4 59.95 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.033 -1.042 . . . . 0.0 109.585 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.54 -31.23 63.55 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.057 -1.027 . . . . 0.0 109.759 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.448 ' O ' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.47 -51.84 32.3 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.978 -1.076 . . . . 0.0 109.751 -179.666 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.626 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -43.25 -36.75 1.9 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.548 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.402 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mm -63.65 -41.31 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.339 -0.85 . . . . 0.0 110.455 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.543 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 1.6 tm0? -87.06 -15.74 37.67 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.489 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER -99.25 61.47 1.22 Allowed 'General case' 0 C--N 1.3 -1.579 0 CA-C-O 122.261 1.029 . . . . 0.0 109.925 -179.089 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.553 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 14.3 p -179.86 56.63 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.27 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.555 ' O ' ' NE1' ' A' ' 81' ' ' TRP . 3.1 p -77.87 156.01 30.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.058 -1.026 . . . . 0.0 110.025 -179.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.13 12.35 0.57 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.815 . . . . 0.0 109.847 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.455 ' H ' ' C ' ' A' ' 53' ' ' THR . 20.9 m-20 -97.89 1.21 47.85 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.199 -0.938 . . . . 0.0 109.74 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.419 HG21 ' H ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.34 -179.65 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.043 -1.036 . . . . 0.0 110.293 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.419 ' H ' HG21 ' A' ' 56' ' ' VAL . 5.2 ptp180 -140.17 138.64 35.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.32 -0.862 . . . . 0.0 110.024 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.497 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.7 pp -172.22 169.09 5.54 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.418 -0.802 . . . . 0.0 109.409 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -101.02 153.02 19.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.028 -1.045 . . . . 0.0 109.081 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -123.94 152.31 42.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.302 -0.874 . . . . 0.0 109.045 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.661 ' CD1' ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -140.47 96.34 3.02 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.413 -0.805 . . . . 0.0 109.087 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.5 ' O ' ' CE2' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -133.99 129.87 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 120.735 -1.228 . . . . 0.0 109.869 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.619 ' HE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ptm180 -68.16 142.86 55.6 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.175 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.5 ' CE2' ' O ' ' A' ' 62' ' ' VAL . 97.9 m-85 -118.79 155.92 30.3 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.796 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 m -81.75 131.43 35.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.157 -0.965 . . . . 0.0 109.037 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 66' ' ' THR . 0.2 OUTLIER -109.88 78.62 1.14 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.353 -0.842 . . . . 0.0 109.484 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 92.29 94.5 1.4 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 68' ' ' ASP . 0.0 OUTLIER -48.8 90.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -1.132 . . . . 0.0 109.492 179.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.553 ' O ' ' N ' ' A' ' 71' ' ' SER . . . -138.02 146.28 42.88 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.3 -0.875 . . . . 0.0 109.46 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 32.1 mtt -65.89 43.1 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.255 -0.903 . . . . 0.0 109.473 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.553 ' N ' ' O ' ' A' ' 69' ' ' ALA . 0.6 OUTLIER -102.49 -11.18 18.74 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.256 -0.902 . . . . 0.0 109.396 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' A' ' 71' ' ' SER . 27.6 mttt 43.21 53.0 5.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.239 -0.913 . . . . 0.0 109.493 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.489 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.6 tpp180 -107.21 -50.06 3.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.352 -0.843 . . . . 0.0 109.513 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.619 ' CB ' ' HE ' ' A' ' 63' ' ' ARG . 21.0 p 58.76 148.55 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.366 -0.834 . . . . 0.0 109.669 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.494 ' NZ ' ' CD2' ' A' ' 129' ' ' LEU . 3.7 ttpt -104.59 170.2 8.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.443 -0.786 . . . . 0.0 109.08 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.522 ' O ' ' N ' ' A' ' 109' ' ' ALA . 79.1 m-85 -134.06 126.78 30.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.126 -0.984 . . . . 0.0 111.289 -178.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.79 166.6 24.79 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.518 -0.739 . . . . 0.0 110.439 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.1 tt -113.85 151.43 32.14 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 7.6 mt -128.22 131.93 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 120.949 -1.094 . . . . 0.0 109.563 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.5 m -100.98 124.61 46.96 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.348 -0.845 . . . . 0.0 109.831 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.555 ' NE1' ' O ' ' A' ' 53' ' ' THR . 58.0 t-105 -102.45 111.96 24.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.175 -0.953 . . . . 0.0 109.831 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mm -109.86 93.35 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.26 153.95 48.03 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -104.63 56.26 0.71 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.63 -0.923 . . . . 0.0 109.612 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 86' ' ' VAL . 7.9 t70 -158.59 -39.02 0.06 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.217 -0.927 . . . . 0.0 109.528 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.435 ' C ' ' O ' ' A' ' 85' ' ' ASP . 12.6 p -40.87 156.97 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.981 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.95 -176.1 0.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.312 -0.868 . . . . 0.0 109.54 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.459 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.35 -22.76 53.46 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -46.68 -70.03 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.153 -1.204 . . . . 0.0 110.074 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.433 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 17.3 mt-30 -48.06 -21.71 0.5 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 109.82 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.459 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 5.7 ttt180 -58.66 -45.26 89.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.966 -1.084 . . . . 0.0 109.578 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.48 -37.4 56.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.247 -0.908 . . . . 0.0 109.793 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 94' ' ' THR . 4.4 mttm -73.71 -52.94 11.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.154 -0.966 . . . . 0.0 109.539 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.411 ' C ' ' O ' ' A' ' 93' ' ' LYS . 59.6 m -45.34 -56.02 5.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -44.38 -60.2 3.76 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -63.79 -50.73 67.83 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.974 -1.309 . . . . 0.0 110.223 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.521 ' OD1' ' CD1' ' A' ' 36' ' ' ILE . 3.4 t70 -57.14 -47.05 82.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.989 -1.069 . . . . 0.0 110.283 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 97' ' ' ASP . 6.1 ptmt -47.62 -33.32 6.52 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.839 -1.145 . . . . 0.0 107.984 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.7 m -59.87 -40.33 88.29 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.487 ' N ' ' O ' ' A' ' 97' ' ' ASP . 95.6 mt -49.75 -60.4 2.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.582 ' C ' ' H ' ' A' ' 103' ' ' GLU . 21.6 t -53.36 -46.62 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -65.44 7.85 0.19 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.582 ' H ' ' C ' ' A' ' 101' ' ' VAL . 19.8 tt0 -100.05 -44.58 5.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.427 -0.796 . . . . 0.0 110.325 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.643 ' CA ' ' HZ3' ' A' ' 7' ' ' LYS . 77.2 t -126.01 60.05 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.233 -0.917 . . . . 0.0 110.839 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.405 HG22 ' HZ2' ' A' ' 7' ' ' LYS . 4.2 t -130.52 96.94 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.075 -1.016 . . . . 0.0 109.56 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.615 ' C ' ' H ' ' A' ' 108' ' ' PHE . 35.0 mt-30 -120.2 -35.67 3.4 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.444 ' CG ' ' O ' ' A' ' 107' ' ' ASN . 36.6 t30 -62.53 35.45 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.7 -0.625 . . . . 0.0 110.298 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.615 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -139.14 150.69 45.93 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.164 -0.96 . . . . 0.0 108.983 178.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.522 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -79.48 -44.27 21.6 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.331 -0.856 . . . . 0.0 109.502 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -160.87 159.51 29.87 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.143 -0.973 . . . . 0.0 109.481 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.62 157.41 17.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.25 -0.906 . . . . 0.0 109.164 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -117.75 142.35 47.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.643 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.8 t -110.6 97.03 5.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.427 HD13 HG22 ' A' ' 114' ' ' ILE . 10.3 mm -103.47 152.32 6.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 O-C-N 121.3 -0.875 . . . . 0.0 110.828 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.5 p -139.77 5.37 2.17 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -160.46 155.39 24.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.386 -0.821 . . . . 0.0 109.271 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 20.7 mtm180 -67.08 -24.12 65.93 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 0.0 109.769 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -69.33 -23.03 63.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.0 109.216 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.421 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 30.0 mt-10 -86.56 -1.89 58.02 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.389 -0.819 . . . . 0.0 109.648 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.9 mt -107.08 25.54 11.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.257 -0.902 . . . . 0.0 109.429 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -82.98 146.32 28.85 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.403 -0.811 . . . . 0.0 109.646 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 1.003 ' HB2' ' NH2' ' A' ' 126' ' ' ARG . 0.2 OUTLIER -52.56 -55.32 23.04 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.132 -0.98 . . . . 0.0 109.338 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.11 -19.66 14.14 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.306 -0.872 . . . . 0.0 110.232 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.501 ' C ' ' CD1' ' A' ' 124' ' ' PHE . 16.5 t80 -86.86 -49.14 7.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.215 -0.928 . . . . 0.0 109.074 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.3 mm -75.96 -25.7 17.2 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.788 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 1.003 ' NH2' ' HB2' ' A' ' 122' ' ' GLU . 1.8 ttm-85 -73.04 -54.64 8.05 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.159 -0.963 . . . . 0.0 109.007 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.8 t -63.81 -12.39 35.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.412 -0.805 . . . . 0.0 109.578 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -84.82 -38.11 19.93 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.19 -0.944 . . . . 0.0 109.601 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.494 ' CD2' ' NZ ' ' A' ' 75' ' ' LYS . 92.2 mt -72.57 -39.99 66.98 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.946 . . . . 0.0 109.315 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 1.017 ' CA ' ' HZ3' ' A' ' 130' ' ' LYS . 0.0 OUTLIER -62.4 -15.75 50.75 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.094 -1.004 . . . . 0.0 109.512 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.573 ' O ' ' N ' ' A' ' 133' ' ' GLY . 0.1 OUTLIER -75.29 -69.81 0.46 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.318 -0.864 . . . . 0.0 109.498 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -60.32 74.76 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.282 -0.886 . . . . 0.0 109.485 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 131' ' ' LYS . . . -90.22 136.53 13.5 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 60.77 -173.37 5.92 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.417 ' C ' ' H ' ' A' ' 137' ' ' TYR . . . -172.59 -38.75 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.279 -1.13 . . . . 0.0 109.443 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.464 ' O ' ' O ' ' A' ' 140' ' ' GLN . 9.8 p-10 -73.51 8.87 1.58 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.361 -0.837 . . . . 0.0 109.548 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.417 ' H ' ' C ' ' A' ' 135' ' ' ALA . 31.7 t80 -92.05 -31.66 15.48 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.192 -0.942 . . . . 0.0 109.439 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.07 -29.72 62.02 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.26 -0.9 . . . . 0.0 109.507 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -95.34 -123.72 0.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.354 -0.841 . . . . 0.0 109.497 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.464 ' O ' ' O ' ' A' ' 136' ' ' ASN . 68.7 mm-40 -78.56 161.93 26.66 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.936 . . . . 0.0 109.426 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 14.1 p -87.58 52.27 2.44 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.266 -0.896 . . . . 0.0 109.531 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 118.028 -0.987 . . . . 0.0 109.464 179.997 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.425 ' H3 ' ' H ' ' A' ' 2' ' ' ALA . 29.2 mtt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.283 0.563 . . . . 0.0 109.496 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.425 ' H ' ' H3 ' ' A' ' 1' ' ' MET . . . -153.29 9.37 0.42 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.319 -0.863 . . . . 0.0 109.446 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -139.45 147.83 41.9 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.317 -0.864 . . . . 0.0 109.48 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -134.06 118.27 17.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.385 -0.822 . . . . 0.0 109.176 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.89 140.41 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.869 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 2.6 t70 -97.07 45.48 1.04 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 108.959 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.446 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -40.46 -21.58 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.432 -0.793 . . . . 0.0 109.724 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.7 tt0 -52.88 -42.17 65.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.241 -0.912 . . . . 0.0 109.28 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.57 -67.04 0.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.192 -0.942 . . . . 0.0 109.419 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.66 ' SG ' ' CE2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -44.69 -60.59 1.93 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.206 -0.934 . . . . 0.0 109.701 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.568 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 11.3 ttp180 -44.22 -58.54 2.82 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.927 -1.108 . . . . 0.0 109.778 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.68 -28.94 16.27 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.062 -1.024 . . . . 0.0 109.229 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.437 ' N ' ' O ' ' A' ' 10' ' ' CYS . . . -87.69 -50.92 6.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.198 -0.938 . . . . 0.0 109.776 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -45.74 -56.17 5.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.941 -179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.723 HD21 ' ND2' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -64.25 -40.1 95.31 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.11 -0.994 . . . . 0.0 109.411 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.6 -25.5 66.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.884 . . . . 0.0 109.275 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.431 ' CG2' ' O ' ' A' ' 13' ' ' ALA . 29.6 t -80.88 -13.9 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.245 -0.909 . . . . 0.0 109.377 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.481 ' O ' ' O ' ' A' ' 19' ' ' ASP . 56.5 mtm180 -73.13 -17.85 61.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.241 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.584 ' OD2' ' N ' ' A' ' 22' ' ' SER . 54.1 p-10 -59.44 -145.7 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.298 -0.876 . . . . 0.0 109.487 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.12 4.81 34.56 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.313 -0.867 . . . . 0.0 108.854 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.484 ' H ' ' CG ' ' A' ' 19' ' ' ASP . . . 127.05 67.07 0.15 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.584 ' N ' ' OD2' ' A' ' 19' ' ' ASP . 0.2 OUTLIER -65.1 -32.14 73.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.158 -1.201 . . . . 0.0 109.633 -179.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . 158.92 -77.49 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.498 -0.751 . . . . 0.0 110.191 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.552 ' O ' ' CG2' ' A' ' 24' ' ' VAL . 12.4 m -59.35 70.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.31 -0.869 . . . . 0.0 110.449 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.585 ' N ' ' O ' ' A' ' 23' ' ' ALA . 2.2 tt -45.69 -41.73 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.923 -1.11 . . . . 0.0 108.366 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.437 ' H ' HG23 ' A' ' 25' ' ' ILE . 33.2 p-90 -142.95 136.97 29.07 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.714 -1.241 . . . . 0.0 109.776 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -115.24 144.87 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.42 -0.8 . . . . 0.0 110.107 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.4 p -133.71 144.02 48.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.429 -0.795 . . . . 0.0 110.972 -179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.66 ' CE2' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -129.42 130.05 45.47 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 179.297 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -107.7 149.43 28.15 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.465 -0.772 . . . . 0.0 109.597 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.479 ' OH ' ' OG1' ' A' ' 94' ' ' THR . 6.0 m-85 -49.02 98.73 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.455 -0.778 . . . . 0.0 109.912 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.64 101.61 13.48 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.94 -119.07 16.59 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.08 22.83 15.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.394 -1.062 . . . . 0.0 110.015 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 m -145.7 129.35 17.1 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.19 -0.944 . . . . 0.0 109.765 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.577 ' CD1' ' N ' ' A' ' 36' ' ' ILE . 1.6 mp -78.54 113.84 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 108.947 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.424 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -135.58 153.7 77.77 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.285 -0.884 . . . . 0.0 109.822 -179.304 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.424 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.9 Cg_exo -32.02 145.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.357 0 C-N-CA 122.989 2.46 . . . . 0.0 112.26 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -139.1 -33.38 0.17 Allowed Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.542 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -143.28 -179.0 6.13 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 121.715 -0.873 . . . . 0.0 109.276 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.674 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -153.17 -171.53 3.95 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.797 0.808 . . . . 0.0 110.838 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -166.71 128.2 1.71 Allowed Glycine 0 N--CA 1.483 1.822 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.08 -10.04 17.43 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -155.35 172.05 18.85 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.467 ' OH ' ' O ' ' A' ' 120' ' ' LEU . 9.4 t80 -70.22 -45.83 65.75 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 120.895 -1.128 . . . . 0.0 109.332 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.458 ' N ' ' CD ' ' A' ' 46' ' ' GLN . 1.2 mp0 -46.94 -39.19 11.84 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.083 -1.011 . . . . 0.0 110.087 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.633 ' CE1' HE22 ' A' ' 41' ' ' GLN . 0.4 OUTLIER -53.18 -24.65 11.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.696 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.576 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -72.3 -25.77 61.71 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.175 -0.953 . . . . 0.0 109.074 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.411 HG12 ' CE2' ' A' ' 48' ' ' PHE . 7.4 mt -83.35 -15.81 11.41 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 O-C-N 121.104 -0.998 . . . . 0.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.514 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 13.6 tp60 -88.3 -53.18 4.82 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.986 -1.071 . . . . 0.0 110.665 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.614 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -102.79 55.87 0.77 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.509 -0.745 . . . . 0.0 111.681 -177.427 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.576 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 34.4 m -155.38 63.64 0.62 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.93 -1.106 . . . . 0.0 109.792 179.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.614 ' C ' ' H ' ' A' ' 55' ' ' ASP . 10.2 p -87.75 158.67 18.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.146 -0.971 . . . . 0.0 110.029 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -60.23 12.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.333 -0.854 . . . . 0.0 110.56 -179.69 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.614 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -111.23 27.79 9.35 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 109.878 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.536 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.0 OUTLIER -148.21 148.76 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.087 -1.008 . . . . 0.0 109.816 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -125.99 128.75 47.96 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.459 -0.776 . . . . 0.0 109.625 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.584 ' O ' ' N ' ' A' ' 81' ' ' TRP . 2.7 pp -172.64 -173.38 1.0 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.046 -1.034 . . . . 0.0 109.985 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.564 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 3.4 m-85 -114.68 159.18 20.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.354 -0.842 . . . . 0.0 108.812 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 79' ' ' ILE . . . -139.34 150.99 46.01 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.789 -1.194 . . . . 0.0 109.143 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.516 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 28.1 t80 -148.86 97.11 2.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.175 -0.953 . . . . 0.0 109.181 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -117.07 152.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.071 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.9 119.07 22.26 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.491 -0.756 . . . . 0.0 109.163 179.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -100.47 156.22 17.39 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 0.0 109.573 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.0 t -77.73 141.64 39.19 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.17 -0.956 . . . . 0.0 108.975 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.509 ' O ' ' NZ ' ' A' ' 130' ' ' LYS . 1.7 m -109.9 -24.05 11.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.472 -0.767 . . . . 0.0 109.42 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.581 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 81.04 106.33 0.32 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 59.34 -76.11 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -1.16 . . . . 0.0 109.465 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 67' ' ' GLY . . . 50.81 -169.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 0.0 109.423 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.515 ' C ' ' H ' ' A' ' 72' ' ' LYS . 0.0 OUTLIER -137.83 121.83 17.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.46 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.14 1.22 0.33 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.315 -0.866 . . . . 0.0 109.455 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.515 ' H ' ' C ' ' A' ' 70' ' ' MET . 77.8 mttt -147.98 62.97 1.12 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.198 -0.939 . . . . 0.0 109.465 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 72' ' ' LYS . 2.3 mtt180 -43.29 -54.47 4.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.193 -0.942 . . . . 0.0 109.475 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.87 157.03 17.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.8 mmtt -104.63 158.09 16.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 109.813 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.49 ' O ' ' N ' ' A' ' 109' ' ' ALA . 65.7 m-85 -133.5 118.99 18.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.486 -0.759 . . . . 0.0 109.459 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.28 160.33 41.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.407 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.3 tt -105.99 157.13 17.73 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.462 ' N ' ' O ' ' A' ' 60' ' ' ALA . 2.8 mt -135.13 136.1 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.072 -1.017 . . . . 0.0 108.961 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -95.96 117.16 30.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.584 ' N ' ' O ' ' A' ' 58' ' ' LEU . 66.8 t-105 -95.22 111.25 23.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.869 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.415 ' O ' ' C ' ' A' ' 83' ' ' GLY . 4.4 mm -116.41 92.77 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.66 161.77 0.06 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -88.85 -27.49 21.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.344 -1.092 . . . . 0.0 109.565 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.9 47.59 0.87 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.323 -0.86 . . . . 0.0 109.664 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.23 166.26 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.286 -0.884 . . . . 0.0 109.733 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.533 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 11.2 t -87.11 -170.92 3.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.398 -0.814 . . . . 0.0 109.748 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.533 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.2 -16.64 66.56 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.418 ' CA ' ' HZ3' ' A' ' 93' ' ' LYS . 10.8 mt -45.93 -41.37 11.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.134 -1.215 . . . . 0.0 109.822 -179.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.579 ' H ' ' CD ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -68.76 -29.38 67.76 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.113 -0.992 . . . . 0.0 109.076 179.641 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.439 ' N ' ' O ' ' A' ' 88' ' ' GLY . 10.0 tmm_? -53.59 -60.78 2.87 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 110.206 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.62 -42.63 34.27 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.11 -0.994 . . . . 0.0 110.131 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.418 ' HZ3' ' CA ' ' A' ' 89' ' ' LEU . 54.8 mttp -61.96 -63.65 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.102 -0.999 . . . . 0.0 110.049 -179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.479 ' OG1' ' OH ' ' A' ' 31' ' ' TYR . 13.6 m -45.33 -51.56 10.92 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.152 -0.967 . . . . 0.0 109.806 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -43.19 -65.46 1.45 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -49.48 72.93 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.106 -1.232 . . . . 0.0 111.34 -178.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.557 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.1 OUTLIER -68.23 -39.75 82.22 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.87 -1.144 . . . . 0.0 111.593 -177.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -60.35 -23.95 64.67 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 120.732 -1.23 . . . . 0.0 109.251 -179.593 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.0 m -83.32 -20.52 34.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 108.694 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -79.56 -61.22 2.07 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.433 -0.792 . . . . 0.0 109.366 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.1 p -56.46 -28.37 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.244 -0.91 . . . . 0.0 109.971 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -71.55 -39.56 70.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.127 -0.983 . . . . 0.0 109.708 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.62 -31.4 69.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.111 -0.993 . . . . 0.0 110.097 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.6 t -97.14 36.92 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.544 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 8.4 p -119.53 66.02 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.272 -0.892 . . . . 0.0 109.404 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.15 42.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.204 -0.935 . . . . 0.0 109.802 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.723 ' ND2' HD21 ' A' ' 15' ' ' ASN . 4.3 m-20 -136.33 -31.04 0.9 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.553 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -72.78 -164.65 0.17 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.323 -0.861 . . . . 0.0 110.104 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -132.6 -27.58 1.71 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.504 -0.747 . . . . 0.0 109.091 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 21.3 tttp -162.2 150.63 14.87 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.304 -0.873 . . . . 0.0 109.404 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.81 149.23 25.83 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.241 -0.912 . . . . 0.0 109.278 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -135.74 153.98 51.39 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.343 -0.848 . . . . 0.0 109.966 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 5.8 p -120.9 137.7 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 4.4 mm -127.07 160.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.858 . . . . 0.0 110.433 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 14.3 t -140.63 5.64 2.01 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -146.06 155.3 42.69 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.37 -0.831 . . . . 0.0 109.392 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -75.99 -30.93 58.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.241 -0.912 . . . . 0.0 110.045 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -76.17 -7.73 55.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.145 -0.972 . . . . 0.0 109.368 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.907 ' OE1' ' CE1' ' A' ' 124' ' ' PHE . 2.4 mm-40 -86.58 3.87 42.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.205 -0.934 . . . . 0.0 109.785 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.467 ' O ' ' OH ' ' A' ' 45' ' ' TYR . 1.6 tp -98.91 -0.35 42.46 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.236 -0.915 . . . . 0.0 108.993 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.19 144.41 12.55 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.578 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.36 -48.58 80.62 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.244 -0.91 . . . . 0.0 109.78 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -56.23 -20.42 18.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.921 . . . . 0.0 109.679 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.907 ' CE1' ' OE1' ' A' ' 119' ' ' GLU . 78.3 t80 -86.67 -50.69 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.169 -0.957 . . . . 0.0 109.269 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -73.7 -25.62 20.89 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -69.47 -51.83 32.35 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.174 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.3 t -63.81 -17.95 63.62 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.275 -0.89 . . . . 0.0 109.325 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -73.06 -42.11 63.43 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.238 -0.914 . . . . 0.0 109.265 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 34.9 mt -73.19 -51.13 18.94 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.276 -0.89 . . . . 0.0 109.099 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.509 ' NZ ' ' O ' ' A' ' 66' ' ' THR . 6.0 mptp? -53.88 -15.85 1.53 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.139 -0.976 . . . . 0.0 109.586 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -74.84 -68.42 0.55 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.273 -0.892 . . . . 0.0 109.451 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.89 76.51 1.16 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.22 -0.925 . . . . 0.0 109.479 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -92.68 94.83 1.93 Allowed Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 54.12 -118.39 9.11 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -143.61 22.07 1.82 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.26 -1.141 . . . . 0.0 109.502 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.441 ' N ' ' OD1' ' A' ' 136' ' ' ASN . 1.5 m120 -61.93 -34.82 76.79 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.165 -0.959 . . . . 0.0 109.517 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -83.67 2.12 39.15 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.277 -0.889 . . . . 0.0 109.519 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.45 -37.08 12.14 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 109.471 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -100.79 10.43 41.15 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.287 -0.883 . . . . 0.0 109.472 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -154.91 109.68 3.01 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.24 -0.913 . . . . 0.0 109.492 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.3 p -90.21 -154.09 0.32 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.224 -0.922 . . . . 0.0 109.511 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 117.96 -1.019 . . . . 0.0 109.454 180.0 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.513 ' O ' ' CB ' ' A' ' 2' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.513 ' CB ' ' O ' ' A' ' 1' ' ' MET . . . 76.05 159.32 0.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.419 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m -158.02 147.57 19.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.21 -0.932 . . . . 0.0 109.457 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.641 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.666 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.578 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.775 HD21 HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -79.65 -7.96 58.9 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.575 ' C ' ' H ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -92.34 158.09 16.28 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.24 -0.913 . . . . 0.0 109.444 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.69 38.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.202 -0.936 . . . . 0.0 109.815 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.575 ' H ' ' C ' ' A' ' 19' ' ' ASP . . . 174.35 -91.77 0.09 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.556 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 0.7 OUTLIER 74.15 -55.11 0.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -1.064 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.556 ' CB ' ' O ' ' A' ' 22' ' ' SER . . . 84.16 52.82 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.541 ' O ' ' CG1' ' A' ' 17' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.448 ' C ' ' O ' ' A' ' 24' ' ' VAL . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.666 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.537 ' OH ' ' CG2' ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.429 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.544 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.464 ' CA ' ' CE2' ' A' ' 26' ' ' TRP . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.432 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 50' ' ' GLN . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.3 mm100 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 56' ' ' VAL . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.433 ' H ' ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.496 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.8 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.673 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER -109.82 77.29 1.04 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.1 130.36 4.24 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.737 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 0.0 OUTLIER -79.08 91.66 4.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -1.133 . . . . 0.0 109.481 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 71' ' ' SER . . . 164.83 132.08 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.23 -0.919 . . . . 0.0 109.445 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.652 ' HE2' ' C ' ' A' ' 70' ' ' MET . 6.3 tpt 54.88 -82.78 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.46 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.578 ' N ' ' O ' ' A' ' 69' ' ' ALA . 1.7 m 54.01 80.27 0.12 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.42 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -86.53 -11.39 51.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.235 -0.916 . . . . 0.0 109.56 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.8 mtt180 -159.33 96.27 1.29 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.248 -0.907 . . . . 0.0 109.634 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.8 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -50.45 -178.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.46 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.525 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.537 ' CG2' ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.409 ' OD2' ' CD1' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.439 ' CG2' ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.478 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.775 HD21 HD21 ' A' ' 15' ' ' ASN . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.59 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.582 ' C ' ' H ' ' A' ' 131' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.33 -7.73 0.26 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.582 ' H ' ' C ' ' A' ' 129' ' ' LEU . 7.3 ttpp 61.26 104.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.797 0.808 . . . . 0.0 109.338 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -139.25 -32.35 0.66 Allowed 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -47.33 162.43 0.26 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -137.58 167.15 24.88 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . -162.87 24.47 0.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -1.164 . . . . 0.0 109.501 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . 0.552 ' N ' ' ND2' ' A' ' 136' ' ' ASN . 0.6 OUTLIER 65.94 -74.02 0.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 109.567 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.446 ' N ' ' O ' ' A' ' 135' ' ' ALA . 74.4 t80 53.05 6.74 0.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.276 -0.89 . . . . 0.0 109.438 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.53 ' H ' ' C ' ' A' ' 136' ' ' ASN . 12.6 t0 -165.29 -87.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -145.86 83.48 1.64 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.527 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 48.84 -99.52 0.06 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.241 -0.912 . . . . 0.0 109.432 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -173.36 4.06 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.911 . . . . 0.0 109.438 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.515 -179.982 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 mtt . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.331 0.586 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 3' ' ' THR . . . -70.86 140.2 51.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.204 -0.935 . . . . 0.0 109.476 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.473 ' O ' ' O ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER 60.33 138.67 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -0.887 . . . . 0.0 109.513 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -140.95 118.24 11.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.302 -0.874 . . . . 0.0 109.344 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 1.609 HD12 ' CG1' ' A' ' 101' ' ' VAL . 15.0 tt -107.53 146.39 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.626 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.8 p30 -75.72 -51.99 11.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.083 -1.01 . . . . 0.0 110.829 -178.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.479 ' N ' ' CG ' ' A' ' 6' ' ' ASP . 5.7 mttm 64.29 -43.06 0.28 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.296 -0.877 . . . . 0.0 109.797 -179.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.8 tm-20 -46.36 -38.83 9.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 109.843 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.9 -60.03 2.47 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.188 -0.945 . . . . 0.0 109.487 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -44.91 -69.65 0.13 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.377 -0.827 . . . . 0.0 110.159 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -45.45 -56.18 5.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.63 -43.96 69.14 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.189 -0.945 . . . . 0.0 110.253 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.01 -45.61 23.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.007 -1.058 . . . . 0.0 110.369 -179.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 3.0 m-30 -45.43 -55.2 6.37 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 110.249 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.71 HD21 ' ND2' ' A' ' 107' ' ' ASN . 0.3 OUTLIER -71.23 -21.64 62.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.062 -1.024 . . . . 0.0 109.803 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.7 tp -72.18 -41.2 67.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.215 -0.928 . . . . 0.0 109.872 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.82 -10.22 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 109.462 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.534 ' O ' ' N ' ' A' ' 20' ' ' ASP . 10.0 ttm180 -76.87 -25.7 53.38 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.239 -0.913 . . . . 0.0 109.306 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -65.45 64.94 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.286 -0.884 . . . . 0.0 109.512 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.534 ' N ' ' O ' ' A' ' 18' ' ' ARG . 33.5 m-20 52.05 25.42 3.18 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.168 -0.958 . . . . 0.0 109.666 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.78 53.9 24.97 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.36 4.81 52.63 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.289 -1.124 . . . . 0.0 109.671 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -140.9 -135.93 0.11 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.149 -0.969 . . . . 0.0 109.988 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.541 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.5 OUTLIER -70.06 128.66 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.415 -0.803 . . . . 0.0 109.907 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.438 HG21 HD11 ' A' ' 25' ' ' ILE . 12.3 tt -61.89 -34.26 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.108 -0.995 . . . . 0.0 108.757 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.604 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 32.1 p-90 -160.29 151.96 19.86 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.268 -0.895 . . . . 0.0 109.386 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.6 m -119.22 141.67 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.442 -0.786 . . . . 0.0 109.355 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -131.99 136.31 47.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.863 . . . . 0.0 109.547 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.496 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.36 163.86 15.72 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.452 ' O ' ' C ' ' A' ' 31' ' ' TYR . 10.6 ptm180 -140.81 147.76 39.54 Favored 'General case' 0 C--N 1.289 -2.029 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.443 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.661 ' OH ' ' OD1' ' A' ' 97' ' ' ASP . 3.9 m-85 -39.85 98.68 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.73 -0.607 . . . . 0.0 110.241 -178.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 1.184 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -96.86 101.42 13.0 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.554 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 51.5 -119.89 9.09 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 108.683 -1.767 . . . . 0.0 108.683 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.96 21.58 17.33 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.364 -1.08 . . . . 0.0 110.095 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 1.184 ' O ' ' OD1' ' A' ' 32' ' ' ASP . 1.4 m -142.3 133.1 25.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 109.781 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.447 ' CA ' ' OD1' ' A' ' 32' ' ' ASP . 1.6 mp -80.64 110.56 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.349 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.879 HG13 ' OD1' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -135.5 153.49 77.76 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.358 -0.839 . . . . 0.0 109.63 -179.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 37' ' ' VAL . 86.4 Cg_exo -33.84 146.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.993 2.462 . . . . 0.0 112.316 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.2 -26.36 0.15 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.545 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -142.89 -178.56 5.87 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.421 -1.046 . . . . 0.0 109.466 -179.475 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.768 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -160.44 177.64 10.36 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 121.746 0.784 . . . . 0.0 110.736 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -163.69 135.82 3.97 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -108.03 -5.44 17.06 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -159.02 175.4 13.58 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -11.24 60.0 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.17 -0.956 . . . . 0.0 109.527 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -78.14 -31.77 49.98 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.936 -1.103 . . . . 0.0 110.149 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -42.9 91.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.002 -1.061 . . . . 0.0 109.549 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.587 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -55.83 -31.22 62.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.342 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.42 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.3 mt -83.2 -13.96 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.016 -1.052 . . . . 0.0 109.999 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -87.18 -52.53 5.36 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.612 -1.305 . . . . 0.0 109.77 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.583 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -100.74 55.05 0.86 Allowed 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 110.896 -178.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.9 t -154.0 67.14 0.73 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.003 -1.06 . . . . 0.0 109.64 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.632 ' C ' ' H ' ' A' ' 55' ' ' ASP . 7.6 p -84.44 154.9 22.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.248 -0.907 . . . . 0.0 110.003 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER -58.05 8.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.478 -0.763 . . . . 0.0 110.482 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.632 ' H ' ' C ' ' A' ' 53' ' ' THR . 2.5 m-20 -109.95 26.78 10.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 0.0 109.366 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.555 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.8 OUTLIER -147.27 148.0 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 109.63 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.581 ' NH2' ' O ' ' A' ' 83' ' ' GLY . 3.2 ptp180 -130.47 133.61 46.43 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 110.329 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.498 ' CD1' ' C ' ' A' ' 58' ' ' LEU . 4.0 pp -172.63 179.51 2.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.698 . . . . 0.0 109.279 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.509 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -113.77 154.24 27.71 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.044 -1.035 . . . . 0.0 109.162 179.814 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -139.39 159.14 42.85 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.015 -1.053 . . . . 0.0 109.294 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 15.0 t80 -148.5 107.56 3.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.641 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -121.48 153.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.339 -0.85 . . . . 0.0 109.641 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -87.08 108.39 18.86 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -90.2 155.5 18.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.278 -0.888 . . . . 0.0 109.927 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -80.74 140.04 35.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 108.809 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.7 m -146.68 110.68 5.01 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.141 -0.974 . . . . 0.0 109.547 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.544 ' C ' ' H ' ' A' ' 69' ' ' ALA . . . 73.29 60.44 3.8 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.433 ' C ' ' OD1' ' A' ' 68' ' ' ASP . 55.8 p30 -70.45 38.29 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -1.122 . . . . 0.0 109.476 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.544 ' H ' ' C ' ' A' ' 67' ' ' GLY . . . -100.43 159.8 14.85 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 109.454 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.423 ' C ' ' O ' ' A' ' 69' ' ' ALA . 27.2 mtt 43.83 -105.11 0.08 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.226 -0.921 . . . . 0.0 109.517 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.02 144.76 32.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.222 -0.924 . . . . 0.0 109.471 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.9 mttm -78.14 73.35 4.7 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.245 -0.909 . . . . 0.0 109.492 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.652 HH11 ' CG ' ' A' ' 73' ' ' ARG . 1.6 mtt-85 -74.19 173.84 9.57 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.931 . . . . 0.0 109.458 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -150.0 157.07 42.78 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.3 -0.875 . . . . 0.0 109.456 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -105.22 153.84 21.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 109.751 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.471 ' O ' ' N ' ' A' ' 109' ' ' ALA . 78.6 m-85 -126.88 120.47 29.3 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.492 -0.755 . . . . 0.0 109.371 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.18 160.4 41.5 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.003 . . . . 0.0 110.496 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.8 tt -108.78 158.0 18.05 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.4 mt -138.31 143.64 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 120.931 -1.105 . . . . 0.0 108.928 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.22 120.26 41.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.193 -0.942 . . . . 0.0 109.696 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.555 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 61.1 t-105 -93.15 112.02 23.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.136 -0.977 . . . . 0.0 109.611 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.1 93.24 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 108.807 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.581 ' O ' ' NH2' ' A' ' 57' ' ' ARG . . . -64.67 160.4 41.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 54' ' ' ASP . 2.4 mm-40 -121.13 71.43 0.95 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.617 -0.931 . . . . 0.0 109.766 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.513 ' O ' ' O ' ' A' ' 86' ' ' VAL . 0.4 OUTLIER -178.12 -24.93 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.05 -1.031 . . . . 0.0 110.067 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.513 ' O ' ' O ' ' A' ' 85' ' ' ASP . 1.9 t -59.51 -134.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.064 -1.022 . . . . 0.0 109.787 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.7 m -125.93 -177.73 4.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.507 -0.746 . . . . 0.0 110.121 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.15 -18.04 63.65 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.903 -1.279 . . . . 0.0 109.903 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mp -47.69 -57.05 6.01 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.186 -1.184 . . . . 0.0 109.864 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.497 ' O ' ' N ' ' A' ' 94' ' ' THR . 1.0 OUTLIER -62.37 -31.38 72.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.192 -0.942 . . . . 0.0 109.729 -179.708 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 4.5 tpt180 -45.09 -65.79 0.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.753 -1.217 . . . . 0.0 110.042 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.61 -33.4 66.66 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.146 -0.971 . . . . 0.0 110.235 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.462 ' C ' ' OH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -69.47 -58.66 3.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.132 -0.98 . . . . 0.0 109.87 -179.59 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.497 ' N ' ' O ' ' A' ' 90' ' ' GLN . 3.5 m -44.64 -36.4 3.07 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.144 -0.972 . . . . 0.0 109.362 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -57.53 -57.1 21.55 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 m -66.45 -47.28 73.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.956 -1.32 . . . . 0.0 111.143 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.661 ' OD1' ' OH ' ' A' ' 31' ' ' TYR . 3.0 m-20 -69.17 -43.27 74.58 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.745 -1.222 . . . . 0.0 111.434 -177.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.405 ' HG3' ' N ' ' A' ' 99' ' ' THR . 0.0 OUTLIER -54.88 -26.11 33.48 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.68 -1.262 . . . . 0.0 108.702 -179.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.405 ' N ' ' HG3' ' A' ' 98' ' ' LYS . 52.5 m -75.66 -29.85 59.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.318 -0.864 . . . . 0.0 108.917 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.7 -58.47 5.03 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 1.609 ' CG1' HD12 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -65.85 -25.92 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.122 -0.986 . . . . 0.0 110.441 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 19.4 tttp -70.68 -37.99 73.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.06 -1.025 . . . . 0.0 109.945 -179.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.469 ' C ' ' H ' ' A' ' 105' ' ' VAL . 27.6 tt0 -79.26 -37.35 38.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.528 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.458 ' O ' ' OE1' ' A' ' 106' ' ' GLN . 2.9 p -73.19 18.56 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.016 -1.053 . . . . 0.0 110.029 -179.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.469 ' H ' ' C ' ' A' ' 103' ' ' GLU . 4.5 p -98.31 133.5 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.107 -0.996 . . . . 0.0 109.635 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.49 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -138.8 31.15 2.26 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.382 -0.969 . . . . 0.0 108.382 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.71 ' ND2' HD21 ' A' ' 15' ' ' ASN . 17.4 m-20 -136.09 -22.95 1.35 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.611 -0.68 . . . . 0.0 110.118 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PHE . . . . . 0.572 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -81.92 168.35 18.0 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.957 -1.089 . . . . 0.0 110.281 -179.491 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -109.07 -29.33 8.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.566 -0.709 . . . . 0.0 109.166 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -162.28 151.74 15.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 109.404 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.97 154.28 20.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.324 -0.86 . . . . 0.0 109.244 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -136.46 159.13 42.71 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.268 -0.895 . . . . 0.0 109.9 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.6 p -121.67 144.23 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 4.7 mm -129.13 158.51 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.166 -0.959 . . . . 0.0 110.172 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 88.8 p -138.73 2.2 2.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -145.35 154.1 41.95 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.881 . . . . 0.0 109.446 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.9 ttp180 -73.56 -31.36 63.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.215 -0.928 . . . . 0.0 109.856 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.78 -6.99 54.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.129 -0.982 . . . . 0.0 109.483 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.599 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 4.4 mm-40 -86.45 3.54 43.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.103 -0.998 . . . . 0.0 109.778 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 2.4 mt -105.97 13.95 28.61 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 109.001 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -64.62 148.54 50.68 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.514 -0.741 . . . . 0.0 109.793 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.25 -51.78 68.49 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.187 -0.946 . . . . 0.0 109.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -55.25 -21.92 16.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 109.738 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 66.3 t80 -84.83 -49.07 8.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.88 . . . . 0.0 109.143 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -69.32 -12.45 16.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -82.37 -50.31 9.05 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.145 -0.972 . . . . 0.0 109.644 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -24.13 67.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.221 -0.925 . . . . 0.0 110.458 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 129' ' ' LEU . 15.3 pt-20 -85.3 -39.77 17.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.96 -1.088 . . . . 0.0 109.713 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.565 ' C ' ' H ' ' A' ' 131' ' ' LYS . 5.4 mt -75.3 -36.26 61.17 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.121 -0.987 . . . . 0.0 108.664 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.2 -9.84 0.17 Allowed 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.565 ' H ' ' C ' ' A' ' 129' ' ' LEU . 8.5 tttp 61.84 106.13 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.817 0.818 . . . . 0.0 109.367 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -147.69 39.14 0.95 Allowed 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.848 -0.741 . . . . 0.0 109.513 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 49.5 -160.04 1.02 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 149.98 30.46 0.05 OUTLIER Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -157.67 -67.48 0.09 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.307 -1.114 . . . . 0.0 109.526 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -77.43 -22.44 51.47 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.255 -0.903 . . . . 0.0 109.524 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.98 -23.8 61.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.284 -0.885 . . . . 0.0 109.429 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . 0.557 ' N ' ' OD1' ' A' ' 138' ' ' ASP . 0.3 OUTLIER -152.94 70.18 0.87 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.213 -0.93 . . . . 0.0 109.498 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -78.42 -56.57 4.34 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.212 -0.93 . . . . 0.0 109.414 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -86.82 -139.86 0.09 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.282 -0.886 . . . . 0.0 109.535 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -143.63 94.73 2.64 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.92 . . . . 0.0 109.541 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.51 -179.962 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.556 HG21 ' OD1' ' A' ' 97' ' ' ASP . 19.7 m . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.28 118.36 18.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.415 -0.803 . . . . 0.0 109.079 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -107.57 139.62 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.333 -0.854 . . . . 0.0 109.89 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.591 ' O ' ' N ' ' A' ' 8' ' ' GLU . 46.9 t0 -100.54 35.71 2.07 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.273 -0.892 . . . . 0.0 108.989 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.725 ' HD2' HG11 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -43.63 -16.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.933 . . . . 0.0 109.4 -179.62 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.591 ' N ' ' O ' ' A' ' 6' ' ' ASP . 5.3 tt0 -54.11 -40.54 67.39 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.168 -0.957 . . . . 0.0 108.823 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -68.22 -63.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.384 -0.822 . . . . 0.0 108.804 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.647 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.2 m -44.65 -53.28 7.38 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.294 -0.879 . . . . 0.0 109.009 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 10' ' ' CYS . 20.6 ttt180 -43.55 -59.73 2.05 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.099 -1.0 . . . . 0.0 109.456 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.42 -40.79 2.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.389 -0.819 . . . . 0.0 109.556 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.86 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -86.46 -35.9 19.38 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.088 -1.008 . . . . 0.0 110.018 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.576 ' CE1' ' CZ ' ' A' ' 61' ' ' PHE . 1.2 t80 -45.44 -67.95 0.24 Allowed 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.431 -0.793 . . . . 0.0 110.36 -179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.548 ' CG ' ' ND2' ' A' ' 107' ' ' ASN . 0.8 OUTLIER -75.69 -32.74 60.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.356 -0.84 . . . . 0.0 110.746 -178.72 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.539 ' C ' ' H ' ' A' ' 18' ' ' ARG . 12.6 tp -69.13 -27.89 65.97 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.749 -1.22 . . . . 0.0 109.146 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.86 HG23 ' O ' ' A' ' 13' ' ' ALA . 22.5 t -58.66 -1.65 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.539 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.592 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.651 ' O ' HG13 ' A' ' 24' ' ' VAL . 6.9 p -46.44 91.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.992 -1.067 . . . . 0.0 108.932 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.5 tt -43.98 -54.07 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 121.25 -0.906 . . . . 0.0 109.7 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.653 ' CZ3' HG23 ' A' ' 28' ' ' THR . 41.8 p-90 -143.99 166.71 24.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.505 -1.372 . . . . 0.0 111.498 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.582 HG21 ' HB3' ' A' ' 13' ' ' ALA . 4.1 m -136.34 138.84 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.602 -0.686 . . . . 0.0 109.4 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.653 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 46.8 p -125.87 141.14 52.13 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.308 -0.87 . . . . 0.0 110.173 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.647 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.21 160.89 25.6 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.662 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -137.87 146.69 43.69 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 121.243 -0.911 . . . . 0.0 109.59 -179.598 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.567 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 4.7 m-85 -59.75 98.5 0.05 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.462 -0.774 . . . . 0.0 110.019 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.574 ' OD1' ' N ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -94.97 102.16 13.97 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.375 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.97 -119.84 7.0 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.2 26.89 10.1 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.325 -1.103 . . . . 0.0 110.615 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.484 ' C ' HD12 ' A' ' 36' ' ' ILE . 8.3 m -145.57 151.17 37.7 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.854 -1.154 . . . . 0.0 110.686 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.656 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.8 mp -101.55 107.22 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.44 HG22 ' CG ' ' A' ' 32' ' ' ASP . 0.9 OUTLIER -135.7 151.81 74.95 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.292 -0.88 . . . . 0.0 110.018 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.2 Cg_exo -31.88 139.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 123.069 2.513 . . . . 0.0 112.391 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.12 -35.56 0.21 Allowed Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.615 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.7 m-20 -142.71 -179.02 6.07 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.806 -0.82 . . . . 0.0 108.878 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.631 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -159.25 -170.19 2.89 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.368 -0.832 . . . . 0.0 110.138 -179.778 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.592 ' HA2' ' CD2' ' A' ' 47' ' ' HIS . . . -168.18 140.62 6.31 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.42 -4.78 15.4 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.04 175.22 13.79 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.429 ' O ' ' C ' ' A' ' 46' ' ' GLN . 1.3 t80 -72.18 -46.29 56.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 120.996 -1.065 . . . . 0.0 109.355 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 45' ' ' TYR . 6.3 mm100 -42.22 -29.38 0.24 Allowed 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.294 -0.879 . . . . 0.0 110.077 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.592 ' CD2' ' HA2' ' A' ' 42' ' ' GLY . 1.2 t-80 -66.62 -47.91 71.14 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.073 -1.017 . . . . 0.0 109.135 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.579 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -42.97 -28.0 0.23 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.442 ' C ' ' H ' ' A' ' 51' ' ' GLN . 1.9 mt -75.39 -45.56 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.371 -0.83 . . . . 0.0 110.605 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.432 ' O ' ' OE1' ' A' ' 50' ' ' GLN . 1.1 tm0? -81.4 8.34 9.55 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.615 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -119.82 -22.3 6.86 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.257 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.518 ' O ' HG23 ' A' ' 53' ' ' THR . 0.1 OUTLIER -69.35 141.08 54.29 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.206 -0.934 . . . . 0.0 109.298 179.73 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 52' ' ' CYS . 33.0 p -157.43 114.19 2.97 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.594 -0.842 . . . . 0.0 110.741 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.569 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.5 OUTLIER -64.11 -0.53 1.21 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.434 ' H ' ' C ' ' A' ' 53' ' ' THR . 10.1 m-20 -110.12 19.12 19.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.448 -0.783 . . . . 0.0 109.373 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' OG1' ' A' ' 53' ' ' THR . 0.3 OUTLIER -144.13 166.18 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.0 110.158 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.718 HH12 ' N ' ' A' ' 91' ' ' ARG . 8.4 ptp180 -136.92 136.43 38.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.803 -0.759 . . . . 0.0 109.885 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.729 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.8 pp -172.31 166.59 5.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.395 -0.816 . . . . 0.0 109.692 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.516 ' O ' HG22 ' A' ' 28' ' ' THR . 31.4 m-85 -100.01 156.9 16.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.056 -1.028 . . . . 0.0 108.801 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.506 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -127.64 152.62 47.45 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.187 -0.946 . . . . 0.0 108.99 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.576 ' CZ ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -146.19 96.11 2.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.283 -0.886 . . . . 0.0 109.254 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -121.3 151.64 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.074 -1.016 . . . . 0.0 109.76 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.514 ' CZ ' ' OG ' ' A' ' 74' ' ' SER . 12.5 ttp180 -92.68 117.57 30.13 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -99.44 155.71 17.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.178 -0.951 . . . . 0.0 110.142 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 m -77.77 146.57 35.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.42 -0.8 . . . . 0.0 108.975 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.49 -179.955 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.514 ' OG ' ' CZ ' ' A' ' 63' ' ' ARG . 1.2 m . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tptp -105.3 161.84 13.94 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.353 -0.842 . . . . 0.0 109.711 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -133.09 124.46 27.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.429 -0.794 . . . . 0.0 109.449 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.92 159.39 43.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.839 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.71 ' O ' HD12 ' A' ' 79' ' ' ILE . 8.6 tp -111.25 150.04 30.16 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.71 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.5 mp -128.97 144.03 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.998 -1.064 . . . . 0.0 109.329 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.7 m -105.19 137.25 43.27 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.877 . . . . 0.0 109.944 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.2 t-105 -114.76 110.62 19.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.392 -0.817 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -105.95 93.49 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.16 -0.962 . . . . 0.0 109.119 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.93 155.73 29.84 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 54' ' ' ASP . 5.6 tp10 -105.92 42.9 1.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.458 -1.025 . . . . 0.0 109.521 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -161.84 19.17 0.11 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.167 -0.958 . . . . 0.0 109.613 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.567 HG21 ' HE ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -92.41 164.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.089 -1.007 . . . . 0.0 109.63 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -67.7 169.92 8.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.43 -0.794 . . . . 0.0 109.703 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.28 -16.65 66.35 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.3 mt -61.4 -70.24 0.2 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 110.347 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.437 ' HB2' HH11 ' A' ' 57' ' ' ARG . 1.4 mt-30 -52.4 -26.99 14.0 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.366 -0.834 . . . . 0.0 109.924 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.718 ' N ' HH12 ' A' ' 57' ' ' ARG . 0.5 OUTLIER -52.39 -59.5 4.35 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.046 . . . . 0.0 109.744 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.46 -23.31 66.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 109.823 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.437 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 4.0 tptp -74.91 -48.47 24.54 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.132 -0.98 . . . . 0.0 109.228 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.567 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 13.2 m -46.01 -45.93 16.18 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.218 -0.926 . . . . 0.0 109.27 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -54.53 -58.54 12.79 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.129 -1.188 . . . . 0.0 110.129 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 88.2 m -64.76 -47.31 78.64 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.037 -1.272 . . . . 0.0 111.132 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -71.95 -43.63 64.89 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.771 -1.205 . . . . 0.0 111.612 -177.574 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -54.58 -26.19 30.85 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.668 -1.27 . . . . 0.0 109.127 -179.433 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -27.36 41.54 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -0.879 . . . . 0.0 108.639 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 97' ' ' ASP . 1.9 mt -68.82 -59.22 3.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.508 -0.745 . . . . 0.0 109.607 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.0 p -62.46 -29.33 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.183 -0.948 . . . . 0.0 110.037 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -66.53 -38.16 86.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.152 -0.968 . . . . 0.0 109.663 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -67.42 -24.19 65.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.23 -0.919 . . . . 0.0 109.617 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.725 HG11 ' HD2' ' A' ' 7' ' ' LYS . 20.4 t -86.79 30.27 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.224 -0.922 . . . . 0.0 109.667 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.7 p -95.17 126.5 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.138 -0.977 . . . . 0.0 109.765 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.455 ' C ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -151.7 22.84 0.69 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.323 -0.861 . . . . 0.0 109.943 -179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.588 ' N ' ' OD1' ' A' ' 107' ' ' ASN . 0.1 OUTLIER -148.46 39.92 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.997 -1.064 . . . . 0.0 110.026 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.539 ' C ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -149.15 -165.71 2.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.925 -1.11 . . . . 0.0 110.596 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.426 ' N ' ' CG ' ' A' ' 108' ' ' PHE . . . -118.14 -50.55 2.46 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.747 -0.595 . . . . 0.0 109.773 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.579 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -158.7 157.1 31.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.101 -0.999 . . . . 0.0 109.952 -179.722 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.588 ' OE1' ' N ' ' A' ' 112' ' ' PHE . 0.0 OUTLIER -104.87 159.79 15.52 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.465 -0.772 . . . . 0.0 108.968 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.588 ' N ' ' OE1' ' A' ' 111' ' ' GLU . 23.6 m-85 -136.15 161.72 34.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.183 -0.948 . . . . 0.0 109.772 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 80.6 t -121.36 150.38 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.51 HG22 ' N ' ' A' ' 115' ' ' SER . 56.3 mt -138.65 161.06 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 110.182 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.51 ' N ' HG22 ' A' ' 114' ' ' ILE . 0.3 OUTLIER -141.18 6.3 1.94 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.347 -0.845 . . . . 0.0 109.311 179.449 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -150.95 155.41 39.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.035 -1.04 . . . . 0.0 109.924 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -70.53 -31.96 69.24 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.262 -0.899 . . . . 0.0 109.599 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -67.77 -16.67 64.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.152 -0.967 . . . . 0.0 108.99 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.594 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.0 OUTLIER -86.54 1.64 50.9 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.339 -0.851 . . . . 0.0 109.763 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.566 HD13 ' CD1' ' A' ' 48' ' ' PHE . 6.5 mt -97.49 20.17 12.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.199 -0.938 . . . . 0.0 108.87 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -74.84 152.72 38.92 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.552 -0.718 . . . . 0.0 109.883 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.98 -48.65 57.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 109.844 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -12.32 7.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.063 -1.023 . . . . 0.0 109.744 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.594 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 9.4 t80 -86.58 -49.07 7.81 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.938 0.875 . . . . 0.0 109.371 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 3.4 mt -74.8 -26.35 19.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.729 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.575 ' NE ' ' HZ1' ' A' ' 130' ' ' LYS . 29.9 ttt180 -68.59 -54.57 15.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.9 t -63.77 -15.8 59.57 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.345 -0.847 . . . . 0.0 109.663 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.545 ' CD ' ' CD1' ' A' ' 112' ' ' PHE . 2.2 tt0 -76.6 -39.99 50.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 109.246 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 12.8 mt -73.34 -48.06 37.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.229 -0.919 . . . . 0.0 109.244 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.575 ' HZ1' ' NE ' ' A' ' 126' ' ' ARG . 13.7 mttt . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.116 -0.99 . . . . 0.0 109.376 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.768 HG21 ' OD1' ' A' ' 97' ' ' ASP . 2.7 m . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.473 ' CB ' HG23 ' A' ' 35' ' ' THR . 59.7 mttt -135.26 118.32 16.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.353 -0.842 . . . . 0.0 109.403 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -107.76 141.23 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.398 -0.814 . . . . 0.0 109.733 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -100.69 70.11 1.41 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.528 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.769 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -58.98 -24.49 62.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.243 -0.911 . . . . 0.0 109.494 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -46.06 68.14 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.449 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -67.47 0.44 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.549 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.82 -63.0 1.01 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.935 . . . . 0.0 109.845 -179.665 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 10.5 ttp180 -44.59 -56.26 4.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.909 -1.12 . . . . 0.0 109.678 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.44 -54.8 27.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.188 -0.945 . . . . 0.0 109.908 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -66.65 -43.72 83.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.134 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.54 ' CZ ' ' CB ' ' A' ' 61' ' ' PHE . 3.2 m-85 -46.8 -55.24 8.24 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.336 -0.852 . . . . 0.0 110.312 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.94 -28.42 43.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.243 -0.911 . . . . 0.0 110.697 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.405 ' HA ' HD12 ' A' ' 16' ' ' LEU . 33.7 tp -56.49 -19.29 14.68 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.792 -1.192 . . . . 0.0 109.473 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 13' ' ' ALA . 1.5 m -77.58 -2.84 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.226 -0.921 . . . . 0.0 109.415 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.1 mtm180 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 -179.991 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.444 0.64 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.733 HG21 ' CG1' ' A' ' 27' ' ' VAL . 13.9 m -78.4 122.88 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.437 -0.789 . . . . 0.0 109.649 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.859 HG23 ' CD1' ' A' ' 26' ' ' TRP . 14.0 tt -49.96 -34.27 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 120.894 -1.129 . . . . 0.0 108.4 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.859 ' CD1' HG23 ' A' ' 25' ' ' ILE . 37.0 p-90 -160.95 171.57 18.46 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.259 -0.9 . . . . 0.0 109.402 177.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.733 ' CG1' HG21 ' A' ' 24' ' ' VAL . 34.7 m -137.0 143.59 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.249 -0.907 . . . . 0.0 109.287 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.599 HG23 ' CE3' ' A' ' 26' ' ' TRP . 46.0 p -132.47 134.71 45.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.293 -0.879 . . . . 0.0 109.701 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.421 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -123.61 153.97 39.95 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.944 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.71 150.18 52.24 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.521 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.752 ' OH ' HG23 ' A' ' 94' ' ' THR . 1.8 m-85 -55.04 99.28 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.569 -0.707 . . . . 0.0 110.443 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.87 101.08 13.16 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 65.49 -117.32 9.89 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.8 25.64 11.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -1.112 . . . . 0.0 110.113 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -145.42 150.16 36.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.73 179.735 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mt -104.15 108.44 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.334 -0.854 . . . . 0.0 108.989 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.9 m -135.49 158.76 73.74 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.254 -0.904 . . . . 0.0 109.724 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 87.6 Cg_exo -30.08 142.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 123.493 2.795 . . . . 0.0 112.689 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -140.55 -30.67 0.17 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.462 ' OD1' ' OE1' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -142.5 -178.9 5.99 Favored 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.625 -0.926 . . . . 0.0 109.263 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.568 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -162.69 175.68 11.1 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.871 -178.678 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.773 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.14 137.26 4.65 Favored Glycine 0 N--CA 1.486 1.977 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.78 -3.42 20.45 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.0 177.54 10.25 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.37 -10.58 59.54 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 120.883 -1.135 . . . . 0.0 109.218 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -74.99 -36.68 61.99 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.049 -1.032 . . . . 0.0 110.255 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.546 ' O ' ' N ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -62.89 -53.3 56.32 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.966 -1.084 . . . . 0.0 109.569 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.572 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -45.45 -28.02 0.82 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.188 -0.945 . . . . 0.0 108.72 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.455 HG12 ' CE2' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -83.93 -17.01 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.272 -0.892 . . . . 0.0 110.134 179.405 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' A' ' 47' ' ' HIS . 5.3 tt0 -81.73 -54.45 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.775 -1.203 . . . . 0.0 109.176 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.462 ' OE1' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -72.47 -12.13 60.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.795 . . . . 0.0 109.736 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.411 ' C ' ' O ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -42.94 126.28 3.78 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.279 -0.888 . . . . 0.0 109.637 -179.625 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.521 ' C ' ' H ' ' A' ' 55' ' ' ASP . 5.6 p -150.62 110.49 4.08 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.873 0.844 . . . . 0.0 110.608 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -57.38 0.35 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.786 -0.571 . . . . 0.0 110.039 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.521 ' H ' ' C ' ' A' ' 53' ' ' THR . 50.7 t0 -109.05 31.86 5.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 109.56 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.37 168.31 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.022 -1.049 . . . . 0.0 110.477 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.644 HH12 ' N ' ' A' ' 91' ' ' ARG . 5.4 ptp180 -141.95 134.91 28.81 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.274 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.77 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.71 168.94 5.08 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.334 -0.854 . . . . 0.0 109.621 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.531 ' N ' ' CD1' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -108.71 160.56 15.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.128 -0.982 . . . . 0.0 109.003 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.47 157.37 45.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.93 -1.106 . . . . 0.0 109.365 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.54 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 37.1 t80 -148.48 104.2 3.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.278 -0.889 . . . . 0.0 109.221 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -120.07 153.38 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.356 -0.84 . . . . 0.0 109.447 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.495 ' NE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ttp180 -88.36 108.58 19.42 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.476 -0.765 . . . . 0.0 109.049 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -89.24 155.69 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.339 -0.85 . . . . 0.0 109.794 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 65' ' ' THR . 13.9 t -86.16 128.35 34.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.259 -0.901 . . . . 0.0 108.882 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.556 -179.903 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.495 ' CB ' ' NE ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.404 ' NZ ' ' HB1' ' A' ' 109' ' ' ALA . 29.7 tptt -104.83 154.81 19.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.564 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -127.58 122.28 32.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.434 -0.791 . . . . 0.0 109.651 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.496 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -144.62 167.27 22.94 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.64 -179.07 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.952 ' O ' HD12 ' A' ' 79' ' ' ILE . 5.5 tt -122.6 157.98 30.96 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.952 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.3 mp -136.09 149.62 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.96 -1.088 . . . . 0.0 108.626 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . 1.002 HG21 ' NZ ' ' A' ' 98' ' ' LYS . 55.7 m -112.66 120.09 40.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.515 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -95.18 111.87 23.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.124 -0.985 . . . . 0.0 109.853 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.0 mm -108.9 93.2 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 108.673 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.32 153.76 35.05 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -104.03 43.24 1.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.481 -1.011 . . . . 0.0 109.713 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.87 11.82 0.49 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.128 -0.982 . . . . 0.0 109.743 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 87' ' ' SER . 46.9 t -89.16 160.19 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.122 -0.986 . . . . 0.0 109.668 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 86' ' ' VAL . 0.4 OUTLIER -68.32 -176.96 0.81 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.433 -0.792 . . . . 0.0 109.796 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.21 -16.53 66.79 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.83 -70.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.167 -1.196 . . . . 0.0 110.239 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.605 ' CB ' HH11 ' A' ' 57' ' ' ARG . 76.9 mm-40 -60.04 -18.83 49.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.197 -0.94 . . . . 0.0 110.181 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.649 ' CG ' HH11 ' A' ' 91' ' ' ARG . 0.0 OUTLIER -55.25 -58.36 8.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.797 -1.189 . . . . 0.0 109.604 -179.875 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.89 -25.2 32.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.203 -0.936 . . . . 0.0 109.747 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.551 ' NZ ' ' OG1' ' A' ' 3' ' ' THR . 0.1 OUTLIER -72.11 -27.13 62.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 109.075 179.64 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.752 HG23 ' OH ' ' A' ' 31' ' ' TYR . 2.2 m -76.81 -52.1 10.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.396 -0.815 . . . . 0.0 109.106 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.451 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -41.77 -51.86 4.79 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.62 -56.53 9.04 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -1.15 . . . . 0.0 110.125 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.768 ' OD1' HG21 ' A' ' 3' ' ' THR . 84.4 m-20 -44.82 -37.95 4.19 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.13 -0.982 . . . . 0.0 110.52 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 1.002 ' NZ ' HG21 ' A' ' 80' ' ' THR . 0.2 OUTLIER -59.39 -43.36 92.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.775 -1.203 . . . . 0.0 108.193 179.357 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.4 m -46.83 -35.03 5.86 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.108 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.5 mt -71.18 -57.66 4.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.621 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 p -67.9 -13.68 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.169 -0.957 . . . . 0.0 110.052 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.403 ' O ' HG12 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -81.85 -42.51 19.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.0 110.363 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.66 -25.41 30.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.035 -1.041 . . . . 0.0 110.952 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.482 HG21 ' HG2' ' A' ' 7' ' ' LYS . 3.2 p -81.03 -34.09 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 120.805 -1.185 . . . . 0.0 110.169 -179.167 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.432 ' C ' ' O ' ' A' ' 104' ' ' VAL . 7.5 p -42.99 134.09 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.031 -1.043 . . . . 0.0 109.621 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.642 ' O ' ' ND2' ' A' ' 107' ' ' ASN . 4.9 pt20 -141.03 26.6 2.02 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 106' ' ' GLN . 7.8 m120 -144.51 39.72 1.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.498 -0.751 . . . . 0.0 109.603 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.59 ' O ' ' CD1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -142.0 149.09 39.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.0 . . . . 0.0 109.766 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.404 ' HB1' ' NZ ' ' A' ' 75' ' ' LYS . . . -87.19 -33.5 19.34 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.636 ' NZ ' ' CZ ' ' A' ' 112' ' ' PHE . 0.7 OUTLIER -162.32 155.66 20.49 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.279 -0.888 . . . . 0.0 109.353 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -104.45 156.36 18.0 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.319 -0.863 . . . . 0.0 109.171 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.636 ' CZ ' ' NZ ' ' A' ' 110' ' ' LYS . 24.1 m-85 -139.67 157.39 45.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.207 -0.933 . . . . 0.0 109.895 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -119.99 109.22 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.559 -0.713 . . . . 0.0 109.305 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.469 HG23 ' HB3' ' A' ' 119' ' ' GLU . 35.3 mm -98.73 152.02 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.444 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.8 t -139.39 7.23 2.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.265 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.403 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.8 OUTLIER -142.0 155.26 45.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.511 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -70.21 -34.92 73.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.969 . . . . 0.0 109.613 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.699 ' HE2' ' OE2' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -75.28 -16.29 60.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 0.0 109.103 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.58 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.7 mp0 -86.4 -4.85 59.24 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.35 -0.844 . . . . 0.0 109.513 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.455 ' HG ' HG21 ' A' ' 114' ' ' ILE . 0.7 OUTLIER -99.65 8.74 44.12 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.255 -0.903 . . . . 0.0 108.965 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.699 ' OE2' ' HE2' ' A' ' 118' ' ' LYS . 63.7 mt-10 -63.68 139.05 58.73 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 0.0 109.505 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.744 ' OE1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -52.23 -50.62 61.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ASP . . . . . 0.744 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.4 OUTLIER -59.05 -42.47 90.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.895 -1.128 . . . . 0.0 109.687 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.58 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 63.7 t80 -55.48 -44.73 76.78 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.009 0.909 . . . . 0.0 109.064 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -74.47 -25.23 19.21 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -67.49 -52.64 36.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.242 -0.911 . . . . 0.0 109.188 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -20.11 65.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.242 -0.911 . . . . 0.0 109.234 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -71.65 -42.54 67.41 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.307 -0.871 . . . . 0.0 109.271 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.496 HD21 ' HB2' ' A' ' 77' ' ' ALA . 3.7 mt -73.88 -51.64 15.55 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 109.042 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.3 mttm . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.209 -0.932 . . . . 0.0 109.287 179.885 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.919 HG21 ' OD1' ' A' ' 97' ' ' ASP . 7.2 m . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HB2' HG23 ' A' ' 35' ' ' THR . 45.4 mttp -123.67 129.06 50.54 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 109.532 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.503 HG23 ' O ' ' A' ' 5' ' ' ILE . 2.8 tp -107.66 125.37 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.478 -0.764 . . . . 0.0 109.315 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.4 m-20 -97.61 43.39 1.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.208 -0.932 . . . . 0.0 109.293 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -42.32 -18.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 109.53 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 6' ' ' ASP . 34.4 mt-10 -55.89 -49.41 73.5 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 108.981 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -61.64 -66.58 0.51 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.353 -0.842 . . . . 0.0 108.939 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.6 m -44.83 -59.08 2.71 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.286 -0.884 . . . . 0.0 109.17 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.411 ' O ' ' C ' ' A' ' 12' ' ' ALA . 39.0 ttp180 -44.29 -56.06 4.45 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.034 -1.041 . . . . 0.0 109.744 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.74 -50.94 5.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.349 -0.845 . . . . 0.0 109.818 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.914 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -82.93 -35.07 26.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.377 -0.827 . . . . 0.0 110.262 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.704 ' CZ ' ' CE1' ' A' ' 61' ' ' PHE . 3.1 t80 -45.55 -65.79 0.49 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.367 -0.833 . . . . 0.0 110.302 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -70.7 -44.55 66.71 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.326 -0.859 . . . . 0.0 110.756 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.814 ' C ' HD13 ' A' ' 16' ' ' LEU . 0.2 OUTLIER -51.75 -40.82 60.94 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.928 -1.107 . . . . 0.0 109.396 -179.158 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 13' ' ' ALA . 98.3 t -51.31 -2.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 120.934 -1.103 . . . . 0.0 109.735 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.604 ' H ' ' C ' ' A' ' 16' ' ' LEU . 1.6 ttp180 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.114 -0.991 . . . . 0.0 109.127 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.94 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.704 ' O ' HG13 ' A' ' 24' ' ' VAL . 13.0 p -85.53 109.97 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.909 HG23 ' CD1' ' A' ' 26' ' ' TRP . 14.0 tt -56.86 -32.89 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.121 -0.987 . . . . 0.0 108.822 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.909 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.0 p-90 -160.7 149.67 16.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.229 -0.919 . . . . 0.0 109.876 178.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.553 HG11 ' CB ' ' A' ' 13' ' ' ALA . 15.1 m -117.55 134.73 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.487 -0.758 . . . . 0.0 109.263 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.575 HG23 ' CE3' ' A' ' 26' ' ' TRP . 40.8 p -124.9 143.63 50.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.362 -0.836 . . . . 0.0 109.901 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.654 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -121.74 163.6 18.81 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -140.89 146.67 37.77 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.359 -0.838 . . . . 0.0 109.835 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.609 ' OH ' HG23 ' A' ' 94' ' ' THR . 3.3 m-85 -58.99 98.71 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.417 -0.802 . . . . 0.0 110.092 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.488 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.1 OUTLIER -100.02 101.19 12.2 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.433 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 73.08 -122.18 7.96 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.13 22.72 15.51 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.352 -1.087 . . . . 0.0 110.352 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.514 HG23 ' HB2' ' A' ' 4' ' ' LYS . 4.0 m -138.39 153.88 48.92 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.081 -1.012 . . . . 0.0 110.197 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.519 ' O ' HG22 ' A' ' 36' ' ' ILE . 1.7 mp -109.79 103.77 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.411 -0.806 . . . . 0.0 109.139 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.2 m -135.83 154.95 78.21 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.164 -0.96 . . . . 0.0 109.771 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.407 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 88.1 Cg_exo -32.27 140.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 123.231 2.621 . . . . 0.0 112.546 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -141.88 -21.51 0.25 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.551 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.18 -178.89 6.07 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.389 -1.065 . . . . 0.0 109.622 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.741 HE22 ' CD2' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -157.74 179.81 8.86 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.627 0.727 . . . . 0.0 110.761 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.666 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -163.49 133.64 3.12 Favored Glycine 0 N--CA 1.485 1.951 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.456 ' O ' ' OD1' ' A' ' 44' ' ' ASP . . . -106.5 -8.56 17.01 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' A' ' 43' ' ' ALA . 59.5 m-20 -157.57 175.38 14.01 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.09 -41.37 67.39 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.806 -1.184 . . . . 0.0 109.267 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -51.58 -32.81 29.92 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.115 -0.991 . . . . 0.0 110.288 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.741 ' CD2' HE22 ' A' ' 41' ' ' GLN . 2.4 t60 -65.37 -15.42 62.55 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.93 -1.106 . . . . 0.0 109.955 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.579 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -82.09 -27.65 32.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.941 -1.099 . . . . 0.0 108.774 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.445 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.9 mt -79.97 -19.36 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.251 -0.906 . . . . 0.0 110.91 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.424 ' NE2' ' HG2' ' A' ' 51' ' ' GLN . 1.2 pp0? -87.02 -45.92 10.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.391 -1.443 . . . . 0.0 109.967 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.551 ' NE2' ' CG ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -105.32 56.66 0.68 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.261 -0.899 . . . . 0.0 110.884 -178.574 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 t -158.5 65.73 0.44 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.023 . . . . 0.0 109.501 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 55' ' ' ASP . 20.6 p -85.19 150.62 24.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -0.924 . . . . 0.0 109.915 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.495 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 2.5 p30 -51.58 -4.05 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.453 -0.779 . . . . 0.0 109.99 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.553 ' OD1' ' HB3' ' A' ' 85' ' ' ASP . 1.1 t0 -94.64 20.71 8.19 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.03 -1.044 . . . . 0.0 109.307 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.608 HG23 ' NH2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -138.72 151.2 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 0.0 109.654 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.679 ' HG2' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -130.98 131.54 44.45 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.485 -0.76 . . . . 0.0 109.801 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.759 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.66 175.52 3.43 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.995 -1.066 . . . . 0.0 110.504 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.568 ' O ' HG22 ' A' ' 28' ' ' THR . 1.0 OUTLIER -111.24 152.68 26.87 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.501 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -132.57 156.99 45.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.956 -1.09 . . . . 0.0 109.628 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.704 ' CE1' ' CZ ' ' A' ' 14' ' ' TYR . 64.5 t80 -149.46 97.02 2.58 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.217 -0.927 . . . . 0.0 109.361 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.01 156.53 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.307 -0.871 . . . . 0.0 109.467 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -79.66 113.06 17.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.427 -0.796 . . . . 0.0 109.01 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -92.59 154.65 18.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.256 -0.902 . . . . 0.0 109.72 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.2 t -78.26 163.4 25.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 108.975 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.258 -0.901 . . . . 0.0 109.518 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.416 -0.586 . . . . 0.0 109.416 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.451 ' HG3' ' HB2' ' A' ' 109' ' ' ALA . 6.9 ttmt -107.91 165.34 11.53 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.327 -0.858 . . . . 0.0 109.313 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.69 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 2.0 m-85 -133.25 128.65 36.32 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 109.813 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.78 167.06 23.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.341 -0.849 . . . . 0.0 110.581 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tt -117.41 157.65 25.84 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.492 HD11 HD12 ' A' ' 125' ' ' ILE . 3.1 mt -135.16 148.27 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.03 -1.044 . . . . 0.0 109.248 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.44 HG22 HD11 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -108.06 113.95 27.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.356 -0.84 . . . . 0.0 109.827 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.426 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 66.6 t-105 -94.66 111.17 22.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.018 -1.051 . . . . 0.0 109.604 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.44 HD11 HG22 ' A' ' 80' ' ' THR . 20.8 mm -112.24 92.99 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -53.29 149.29 12.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -94.35 35.24 1.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.32 -1.106 . . . . 0.0 109.554 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.553 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -153.29 25.97 0.53 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.679 HG21 ' HG2' ' A' ' 57' ' ' ARG . 4.0 p -98.11 159.63 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.15 -0.968 . . . . 0.0 109.725 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.4 p -71.9 -176.24 1.64 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.0 110.01 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.19 -18.19 63.28 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -46.4 -57.2 4.87 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.083 -1.245 . . . . 0.0 109.618 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 49.0 mm-40 -57.51 -30.97 65.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.208 -0.933 . . . . 0.0 109.23 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 6.6 tpt180 -45.33 -56.42 4.94 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.053 -1.03 . . . . 0.0 109.425 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.82 -35.2 38.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.823 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 10.2 mttt -69.66 -61.64 1.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.128 -0.982 . . . . 0.0 109.875 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.609 HG23 ' OH ' ' A' ' 31' ' ' TYR . 28.4 m -45.02 -49.83 11.11 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.0 109.65 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -51.66 -59.43 8.55 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 74.1 p -65.01 -48.29 74.44 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.014 -1.286 . . . . 0.0 111.173 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.919 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.0 OUTLIER -69.08 -41.1 77.97 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.82 -1.175 . . . . 0.0 111.617 -177.535 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.404 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -61.23 -22.18 64.55 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.768 -1.208 . . . . 0.0 109.459 -179.416 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 20.4 m -73.92 -44.85 53.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.227 -0.92 . . . . 0.0 109.426 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.455 ' N ' HD12 ' A' ' 100' ' ' LEU . 8.1 mp -59.13 -54.73 43.63 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.204 -0.935 . . . . 0.0 109.586 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -28.05 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.164 -0.96 . . . . 0.0 109.914 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.72 -37.93 73.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.14 -0.975 . . . . 0.0 109.784 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -22.39 60.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.158 -0.964 . . . . 0.0 109.732 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.797 ' O ' HG12 ' A' ' 104' ' ' VAL . 88.6 t -94.26 33.82 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.55 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.489 ' O ' HG12 ' A' ' 105' ' ' VAL . 12.1 t -131.75 98.93 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.298 -0.876 . . . . 0.0 109.873 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.595 ' O ' ' N ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -119.1 -41.4 2.75 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.722 ' N ' HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -63.9 41.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 119.936 -0.705 . . . . 0.0 110.073 -179.172 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.595 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -142.4 174.69 10.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.345 -0.847 . . . . 0.0 109.601 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.451 ' HB2' ' HG3' ' A' ' 75' ' ' LYS . . . -88.07 -56.76 3.19 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.205 -0.934 . . . . 0.0 109.5 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.514 ' CG ' ' N ' ' A' ' 111' ' ' GLU . 9.3 ttpp -162.37 167.17 24.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.294 -0.878 . . . . 0.0 109.33 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.514 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -104.37 154.06 20.3 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.192 -0.943 . . . . 0.0 108.968 179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -128.61 156.2 43.74 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.444 -0.785 . . . . 0.0 110.166 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.569 ' O ' HD13 ' A' ' 114' ' ' ILE . 33.4 t -115.16 143.11 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.711 HG21 ' CD2' ' A' ' 120' ' ' LEU . 18.8 mm -136.08 154.07 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.078 -1.013 . . . . 0.0 110.439 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 64.4 m -140.59 3.6 1.9 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.611 -0.681 . . . . 0.0 109.218 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 1.164 ' OD1' ' CD ' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -143.12 155.29 44.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.189 -0.945 . . . . 0.0 109.526 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -73.96 -33.25 63.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 109.824 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.61 -8.76 54.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.199 -0.938 . . . . 0.0 109.007 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 1.164 ' CD ' ' OD1' ' A' ' 116' ' ' ASP . 21.7 mt-10 -86.35 -0.48 56.0 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.711 ' CD2' HG21 ' A' ' 114' ' ' ILE . 2.6 mm? -94.71 1.29 55.49 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.214 -0.929 . . . . 0.0 108.814 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.45 145.77 54.96 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.538 -0.726 . . . . 0.0 109.701 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -62.33 -49.24 76.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 0.0 109.581 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.15 -21.94 15.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.0 109.852 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 67.5 t80 -83.31 -49.21 9.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.301 -0.874 . . . . 0.0 109.148 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.492 HD12 HD11 ' A' ' 79' ' ' ILE . 4.5 mm -71.94 -25.2 23.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -65.09 -52.39 55.83 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.198 -0.939 . . . . 0.0 108.729 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.3 t -58.74 -24.5 61.71 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.323 -0.861 . . . . 0.0 109.197 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.84 -40.65 65.57 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.295 -0.878 . . . . 0.0 109.268 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 75' ' ' LYS . 19.2 mt -73.64 -53.11 11.21 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.219 -0.925 . . . . 0.0 109.131 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 130' ' ' LYS . 11.3 mptt . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.143 -0.973 . . . . 0.0 109.601 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -137.32 118.21 14.22 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.275 -0.891 . . . . 0.0 109.364 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.437 HG23 ' HG3' ' A' ' 7' ' ' LYS . 2.0 tt -110.79 142.72 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.404 -0.81 . . . . 0.0 109.615 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 8' ' ' GLU . 4.5 m-20 -93.4 40.84 1.07 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.189 -0.944 . . . . 0.0 109.154 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.482 ' HB3' HG11 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -40.17 -22.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.712 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.57 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.3 tt0 -50.32 -34.05 22.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.186 -0.946 . . . . 0.0 109.232 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.8 -60.25 2.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.357 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.89 -62.82 1.08 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.209 -0.932 . . . . 0.0 109.682 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.654 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 38.7 ttp180 -45.17 -53.66 7.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.951 -1.093 . . . . 0.0 109.221 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -58.29 8.49 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.339 -0.85 . . . . 0.0 109.757 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.543 ' HB3' HG11 ' A' ' 27' ' ' VAL . . . -58.55 -25.57 62.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.535 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -70.76 -48.31 55.02 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.368 -0.832 . . . . 0.0 109.492 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.499 ' N ' ' OD1' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -79.58 -11.06 59.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.272 -0.893 . . . . 0.0 109.555 -179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.416 ' HA ' HD12 ' A' ' 16' ' ' LEU . 6.6 tp -76.76 -29.01 55.93 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.265 -0.897 . . . . 0.0 109.212 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.696 HG12 HG13 ' A' ' 24' ' ' VAL . 0.8 OUTLIER -72.1 -1.57 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.298 -0.876 . . . . 0.0 109.194 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.512 ' CG ' ' O ' ' A' ' 18' ' ' ARG . 22.1 ttp180 . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.535 -0.728 . . . . 0.0 109.188 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.592 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.696 HG13 HG12 ' A' ' 17' ' ' VAL . 2.5 p -58.41 78.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.98 . . . . 0.0 108.94 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -41.02 -59.04 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 O-C-N 121.409 -0.807 . . . . 0.0 109.949 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.66 ' CE3' HG23 ' A' ' 28' ' ' THR . 27.0 p-90 -134.02 156.49 48.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.826 -1.171 . . . . 0.0 110.834 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.543 HG11 ' HB3' ' A' ' 13' ' ' ALA . 1.5 p -134.27 135.77 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.66 HG23 ' CE3' ' A' ' 26' ' ' TRP . 70.7 p -124.28 146.22 48.91 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.097 -1.002 . . . . 0.0 110.541 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.92 136.9 54.19 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 32' ' ' ASP . 26.9 ptt180 -113.47 146.1 40.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.487 -0.758 . . . . 0.0 109.982 -178.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.531 ' CD2' ' OE1' ' A' ' 90' ' ' GLN . 1.9 m-85 -41.21 98.63 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.565 -0.709 . . . . 0.0 109.781 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -97.1 101.76 13.4 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.853 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 55.83 -119.35 13.74 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.83 22.46 15.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.453 -1.028 . . . . 0.0 110.098 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 43.8 m -145.31 134.06 22.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.123 -0.986 . . . . 0.0 109.909 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.3 mp -78.98 113.45 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.284 -0.885 . . . . 0.0 108.997 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.41 150.5 72.59 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.286 -0.884 . . . . 0.0 109.871 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -35.53 146.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.895 2.397 . . . . 0.0 112.303 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.99 -38.64 0.15 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.754 ' CG ' HE22 ' A' ' 51' ' ' GLN . 3.5 m-20 -142.62 -179.38 6.27 Favored 'General case' 0 C--N 1.296 -1.761 0 O-C-N 121.714 -0.874 . . . . 0.0 109.285 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.621 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -158.12 -169.39 2.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.354 -0.841 . . . . 0.0 109.685 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.15 143.96 7.75 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 119.521 -1.323 . . . . 0.0 110.163 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.04 0.29 29.65 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.463 ' C ' HD13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.29 170.71 19.37 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.425 ' O ' ' C ' ' A' ' 46' ' ' GLN . 17.8 p90 -79.63 -39.72 30.89 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.625 -1.297 . . . . 0.0 109.03 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 45' ' ' TYR . 4.8 mm100 -42.42 -33.84 0.73 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.078 -1.014 . . . . 0.0 109.994 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.518 ' NE2' ' OE1' ' A' ' 50' ' ' GLN . 2.1 t-160 -61.74 -41.75 98.06 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.82 -1.175 . . . . 0.0 109.108 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.648 ' CE1' HD13 ' A' ' 120' ' ' LEU . 0.1 OUTLIER -47.67 -33.22 6.56 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.404 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mt -64.63 -42.11 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.158 -0.964 . . . . 0.0 109.111 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.574 ' NE2' ' O ' ' A' ' 50' ' ' GLN . 5.3 tm0? -86.96 -12.62 47.0 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.754 HE22 ' CG ' ' A' ' 40' ' ' ASP . 24.6 mm-40 -109.97 67.25 0.64 Allowed 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.313 1.054 . . . . 0.0 110.472 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.694 ' SG ' HD11 ' A' ' 58' ' ' LEU . 1.2 m 158.61 59.19 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.009 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.524 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.4 p -77.41 164.02 25.86 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.966 -1.084 . . . . 0.0 109.707 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.3 OUTLIER -65.46 -4.52 5.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.632 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.29 14.46 31.89 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.282 -0.886 . . . . 0.0 109.504 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 53' ' ' THR . 2.5 p -138.18 157.14 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.236 -0.915 . . . . 0.0 109.745 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.522 ' CD ' ' N ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -134.76 129.03 34.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.554 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.752 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.7 pp -172.49 172.73 4.25 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 110.294 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.515 ' O ' HG22 ' A' ' 28' ' ' THR . 2.7 m-85 -104.34 153.55 20.92 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.117 -0.99 . . . . 0.0 108.846 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.427 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.05 156.93 46.48 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.404 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 47.7 t80 -148.91 96.54 2.57 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -113.5 159.27 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.31 -0.868 . . . . 0.0 109.609 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.583 ' NE ' ' OG ' ' A' ' 74' ' ' SER . 1.1 ttt-85 -84.7 140.65 31.14 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.299 -0.875 . . . . 0.0 108.735 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -123.62 156.05 36.55 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.807 . . . . 0.0 110.221 -179.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.6 t -77.22 135.11 38.46 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.476 -0.765 . . . . 0.0 109.5 -179.776 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.583 ' OG ' ' NE ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.93 155.38 19.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.84 . . . . 0.0 109.311 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.442 ' O ' ' N ' ' A' ' 109' ' ' ALA . 93.8 m-85 -134.02 120.25 20.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.394 -0.816 . . . . 0.0 109.746 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.74 167.2 22.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.604 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tt -121.18 155.42 34.59 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.483 HD11 ' CD1' ' A' ' 125' ' ' ILE . 3.2 mm -134.7 143.06 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.168 -0.957 . . . . 0.0 109.046 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.42 HG23 ' CD2' ' A' ' 59' ' ' PHE . 2.7 m -104.14 117.06 33.36 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 109.674 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.5 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -92.97 111.49 23.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.048 -1.033 . . . . 0.0 109.69 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -110.11 93.12 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.323 -0.861 . . . . 0.0 108.746 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.07 158.7 3.0 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -96.95 19.88 12.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.295 -1.121 . . . . 0.0 109.734 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -132.16 26.81 4.53 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.865 . . . . 0.0 109.215 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.485 HG22 ' HD2' ' A' ' 57' ' ' ARG . 4.1 t -91.21 160.98 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.357 -0.839 . . . . 0.0 110.094 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 t -93.37 -161.32 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.379 -0.825 . . . . 0.0 108.985 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -20.62 59.19 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.969 -1.253 . . . . 0.0 109.969 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.59 -64.65 0.71 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.987 -1.302 . . . . 0.0 110.023 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.531 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 41.6 mm-40 -56.75 -30.22 63.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.8 tmm_? -49.6 -59.51 3.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.798 -1.188 . . . . 0.0 109.633 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.38 -39.88 27.58 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.174 -0.954 . . . . 0.0 109.796 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.447 ' C ' ' OH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -60.27 -65.3 0.71 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 109.515 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 51.1 m -45.16 -43.11 9.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.0 109.572 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.07 -60.45 3.5 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.8 m -66.05 -47.95 72.65 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.118 -1.225 . . . . 0.0 111.075 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -68.77 -42.86 76.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.78 -1.2 . . . . 0.0 111.386 -177.8 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -25.12 53.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.595 -1.316 . . . . 0.0 108.745 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 96.1 m -81.33 -20.7 40.14 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 100' ' ' LEU . 53.2 mt -78.98 -63.79 1.33 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.44 -0.787 . . . . 0.0 109.185 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -50.3 -33.11 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.975 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.985 ' HE2' ' HG2' ' A' ' 111' ' ' GLU . 1.4 tttm -75.07 -42.37 57.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.269 -0.894 . . . . 0.0 109.751 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.31 -39.33 85.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.168 -0.957 . . . . 0.0 110.203 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.482 HG11 ' HB3' ' A' ' 7' ' ' LYS . 12.8 p -78.16 -25.68 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.07 -1.018 . . . . 0.0 109.926 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 102' ' ' LYS . 1.0 OUTLIER -42.8 138.4 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.105 -0.997 . . . . 0.0 109.518 -179.927 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -144.29 20.07 1.73 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.072 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -143.18 41.16 1.5 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.896 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.566 ' O ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -142.52 158.0 44.14 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.032 . . . . 0.0 109.867 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -93.6 -34.34 13.35 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.354 -0.842 . . . . 0.0 109.446 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -162.27 159.54 25.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.871 . . . . 0.0 109.314 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.985 ' HG2' ' HE2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -104.2 150.69 24.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.199 -0.938 . . . . 0.0 109.337 -179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 79' ' ' ILE . 62.0 m-85 -133.84 157.62 45.46 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.451 -0.78 . . . . 0.0 109.701 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.6 t -121.19 142.47 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.455 HD12 ' OE1' ' A' ' 119' ' ' GLU . 1.8 mm -137.26 156.59 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.899 . . . . 0.0 110.058 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.482 ' O ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -140.64 9.19 2.2 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.607 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -158.79 157.05 30.88 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.825 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -79.74 -18.96 49.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.918 -1.114 . . . . 0.0 110.209 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -62.8 -50.06 72.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.087 -1.008 . . . . 0.0 110.428 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.607 ' OE2' ' N ' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -80.79 4.74 18.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 0.0 110.279 -179.098 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.648 HD13 ' CE1' ' A' ' 48' ' ' PHE . 0.7 OUTLIER -96.38 16.62 17.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.007 -1.058 . . . . 0.0 108.405 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -74.63 154.6 38.45 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.66 -0.65 . . . . 0.0 109.78 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.41 -48.22 74.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.424 -0.798 . . . . 0.0 109.49 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 1.3 p30 -56.97 -41.59 78.62 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 109.658 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CG ' ' O ' ' A' ' 119' ' ' GLU . 15.4 t80 -60.36 -48.0 83.62 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.094 0.95 . . . . 0.0 109.093 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.483 ' CD1' HD11 ' A' ' 79' ' ' ILE . 1.4 mm -71.22 -40.15 74.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -62.14 -53.37 56.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.203 -0.935 . . . . 0.0 109.039 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -15.06 13.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.384 -0.822 . . . . 0.0 109.49 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.422 ' OE2' ' CZ ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -83.52 -37.24 23.32 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.21 -0.931 . . . . 0.0 109.358 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 46.8 mt -69.08 -39.72 78.88 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.193 -0.942 . . . . 0.0 108.631 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.303 -1.429 0 O-C-N 121.137 -0.977 . . . . 0.0 108.645 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.671 HG21 ' OD1' ' A' ' 97' ' ' ASP . 2.4 m . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.581 ' HB3' HG23 ' A' ' 35' ' ' THR . 0.1 OUTLIER -138.26 125.1 21.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.185 -0.947 . . . . 0.0 109.44 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.3 137.25 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.391 -0.818 . . . . 0.0 109.694 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.558 ' O ' ' N ' ' A' ' 8' ' ' GLU . 6.3 t70 -64.04 -44.61 91.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -0.89 . . . . 0.0 109.381 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.682 ' HD3' HG21 ' A' ' 104' ' ' VAL . 1.5 mtmt 63.89 -50.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.445 -0.785 . . . . 0.0 110.184 179.37 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 6' ' ' ASP . 10.9 mt-10 -51.8 -49.29 63.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.111 -0.993 . . . . 0.0 109.809 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.69 -69.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 109.999 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.613 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 4.1 m -46.08 -65.34 0.56 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.22 -0.925 . . . . 0.0 110.125 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.519 HH11 ' HG3' ' A' ' 11' ' ' ARG . 0.9 OUTLIER -44.78 -58.39 3.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.985 -1.072 . . . . 0.0 110.144 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.95 -45.28 78.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.131 -0.981 . . . . 0.0 110.049 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.425 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -75.88 -17.02 59.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.058 -1.026 . . . . 0.0 110.183 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-30 -74.27 -52.96 10.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.125 -0.984 . . . . 0.0 109.539 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.723 ' ND2' ' NH2' ' A' ' 18' ' ' ARG . 4.1 m120 -71.93 -13.32 61.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 109.42 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.543 HD23 HG22 ' A' ' 24' ' ' VAL . 4.8 tp -70.87 -47.99 56.23 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.356 -0.84 . . . . 0.0 109.575 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 14' ' ' TYR . 18.7 m -64.97 -14.0 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.218 -0.926 . . . . 0.0 109.563 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.723 ' NH2' ' ND2' ' A' ' 15' ' ' ASN . 20.1 ttm180 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.267 -0.896 . . . . 0.0 109.508 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.543 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.806 HG23 ' O ' ' A' ' 24' ' ' VAL . 9.1 m 21.5 69.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-O 120.821 0.343 . . . . 0.0 111.378 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.796 HG23 ' CD1' ' A' ' 26' ' ' TRP . 13.0 tt -46.77 -31.06 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 120.743 -1.223 . . . . 0.0 108.08 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.796 ' CD1' HG23 ' A' ' 25' ' ' ILE . 22.8 p-90 -157.16 147.63 21.22 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.295 -0.878 . . . . 0.0 109.372 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.425 HG21 ' HB3' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -112.84 135.09 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.334 -0.854 . . . . 0.0 110.091 -179.381 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.624 HG22 ' O ' ' A' ' 59' ' ' PHE . 47.5 p -131.18 133.88 45.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.48 -0.762 . . . . 0.0 109.73 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.613 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.44 167.28 14.06 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.488 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -140.89 143.75 34.84 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 119.231 -0.987 . . . . 0.0 109.813 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.638 ' OH ' HG23 ' A' ' 94' ' ' THR . 5.6 m-85 -50.37 98.68 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.544 -0.723 . . . . 0.0 109.744 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.66 101.35 13.04 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.08 -122.71 13.39 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.89 22.31 16.09 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.46 -1.023 . . . . 0.0 110.227 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.581 HG23 ' HB3' ' A' ' 4' ' ' LYS . 35.4 m -146.6 136.0 22.86 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.066 -1.021 . . . . 0.0 109.694 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mp -77.56 115.8 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.108 -0.995 . . . . 0.0 108.768 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -135.31 154.13 78.47 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.244 -0.91 . . . . 0.0 109.822 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -39.67 141.59 0.55 Allowed 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.752 2.301 . . . . 0.0 112.388 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.28 -40.8 0.17 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.568 ' CG ' ' H ' ' A' ' 41' ' ' GLN . 14.8 t70 -144.19 179.65 7.09 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.75 -0.853 . . . . 0.0 108.83 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.624 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -140.81 177.11 8.26 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.406 -0.808 . . . . 0.0 110.546 -179.069 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.611 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -112.19 85.14 0.38 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.592 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -113.77 43.74 1.75 Allowed 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER 143.41 125.55 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.911 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -54.65 -53.86 49.23 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 0.0 109.551 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.462 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 5.1 mp0 -48.54 -20.22 0.41 Allowed 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.2 -0.938 . . . . 0.0 109.79 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.584 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -71.77 -34.01 69.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.195 -0.94 . . . . 0.0 109.225 179.655 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.592 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -56.03 -40.12 73.0 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.433 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.475 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.3 mt -58.74 -55.08 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.902 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.421 ' O ' ' OE1' ' A' ' 50' ' ' GLN . 1.2 tm0? -73.27 7.15 2.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.013 -1.055 . . . . 0.0 108.361 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.585 ' O ' HG23 ' A' ' 53' ' ' THR . 52.2 mm-40 -116.07 -75.73 0.58 Allowed 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.17 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.552 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 2.5 m -65.82 48.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.125 -0.984 . . . . 0.0 109.496 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 51' ' ' GLN . 0.7 OUTLIER -73.75 172.5 11.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.181 -0.949 . . . . 0.0 109.739 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.58 ' OD1' ' N ' ' A' ' 55' ' ' ASP . 1.1 p30 -55.27 -48.27 74.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.273 -0.892 . . . . 0.0 109.763 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.58 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.5 OUTLIER -76.28 42.21 0.26 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 -179.874 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.561 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 96.0 t -148.19 147.18 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 109.836 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -138.38 120.91 16.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.404 -0.81 . . . . 0.0 109.516 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.748 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.5 pp -172.86 175.97 3.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.076 -1.015 . . . . 0.0 110.462 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.624 ' O ' HG22 ' A' ' 28' ' ' THR . 3.9 m-85 -104.46 152.03 22.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.984 -1.072 . . . . 0.0 108.807 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.441 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.43 152.04 51.87 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.965 -1.085 . . . . 0.0 109.017 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.461 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 39.5 t80 -150.82 96.93 2.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.076 . . . . 0.0 109.498 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.55 154.89 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.248 -0.907 . . . . 0.0 108.949 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -80.7 113.29 18.79 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.359 -0.838 . . . . 0.0 108.983 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.546 ' CE2' ' HB3' ' A' ' 77' ' ' ALA . 12.5 m-85 -93.87 155.8 16.99 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.88 . . . . 0.0 109.661 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.97 149.62 34.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.164 -0.96 . . . . 0.0 108.97 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 90.5 m . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.438 -0.789 . . . . 0.0 109.473 179.903 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.616 ' HG2' HD22 ' A' ' 129' ' ' LEU . 0.6 OUTLIER -104.74 157.69 17.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.393 -0.817 . . . . 0.0 109.89 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -133.26 119.73 20.18 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.458 -0.776 . . . . 0.0 109.054 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.698 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -144.09 156.8 44.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.091 -1.006 . . . . 0.0 110.947 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.6 tt -106.57 157.29 17.79 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.55 HG23 HD11 ' A' ' 114' ' ' ILE . 36.9 mt -137.36 133.26 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 120.92 -1.113 . . . . 0.0 109.066 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.44 HG23 ' CD2' ' A' ' 59' ' ' PHE . 1.3 m -95.72 117.76 31.12 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.165 -0.959 . . . . 0.0 109.653 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.561 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -93.02 110.38 21.85 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.089 -1.007 . . . . 0.0 109.729 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -105.21 93.01 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -58.09 156.35 19.76 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.524 ' O ' ' N ' ' A' ' 86' ' ' VAL . 2.9 mm-40 -78.72 -51.47 9.76 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -1.163 . . . . 0.0 109.63 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -67.0 39.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.183 -0.948 . . . . 0.0 109.57 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.524 ' N ' ' O ' ' A' ' 84' ' ' GLU . 92.8 t -96.63 157.3 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.23 -0.919 . . . . 0.0 109.725 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.434 ' N ' HG12 ' A' ' 86' ' ' VAL . 9.2 p -99.38 -161.49 0.88 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.324 -0.86 . . . . 0.0 109.461 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.03 -15.97 68.54 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.8 mp -46.93 -54.27 10.44 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.073 -1.251 . . . . 0.0 109.408 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.54 ' CD ' ' N ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -57.29 -35.16 69.46 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.865 . . . . 0.0 109.165 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.661 ' CG ' HH11 ' A' ' 91' ' ' ARG . 0.0 OUTLIER -47.6 -62.72 1.31 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.061 -1.024 . . . . 0.0 109.961 -179.358 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.09 -40.52 19.72 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.13 -0.981 . . . . 0.0 110.132 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.444 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 56.8 mmtt -61.66 -59.05 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 0.0 110.312 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.638 HG23 ' OH ' ' A' ' 31' ' ' TYR . 27.3 m -55.78 -49.09 74.1 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.962 -1.086 . . . . 0.0 109.516 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.47 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.87 -62.12 2.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.7 p -64.91 -49.26 71.11 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.118 -1.225 . . . . 0.0 111.104 -178.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.671 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.3 OUTLIER -66.85 -42.18 86.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.914 -1.116 . . . . 0.0 111.401 -177.824 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -22.64 63.55 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.623 -1.298 . . . . 0.0 109.201 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -82.3 -21.47 36.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.368 -0.833 . . . . 0.0 108.812 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.4 mt -83.46 -61.94 1.71 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.397 -0.815 . . . . 0.0 109.272 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.614 HG13 ' N ' ' A' ' 102' ' ' LYS . 8.6 p -46.78 -46.85 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.743 ' HD3' ' OE2' ' A' ' 111' ' ' GLU . 3.3 ttmt -66.31 -44.29 83.82 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.232 -0.918 . . . . 0.0 109.615 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -47.98 -68.53 0.18 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.221 -0.925 . . . . 0.0 110.153 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.682 HG21 ' HD3' ' A' ' 7' ' ' LYS . 14.5 p -74.16 42.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -0.947 . . . . 0.0 110.05 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -121.0 167.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.417 -0.802 . . . . 0.0 109.712 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.577 ' C ' ' H ' ' A' ' 108' ' ' PHE . 3.1 pt20 -177.21 -29.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.551 HD22 HH21 ' A' ' 18' ' ' ARG . 0.2 OUTLIER -66.77 26.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.528 -0.732 . . . . 0.0 109.738 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.577 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -139.82 154.29 47.31 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.0 109.478 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.43 -31.98 14.4 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.476 -0.765 . . . . 0.0 109.778 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -162.35 152.37 16.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.743 ' OE2' ' HD3' ' A' ' 102' ' ' LYS . 7.8 pt-20 -104.87 156.9 17.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.894 . . . . 0.0 108.682 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -142.28 158.35 43.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.943 -1.098 . . . . 0.0 110.894 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.764 ' O ' HD13 ' A' ' 114' ' ' ILE . 4.1 p -117.01 158.12 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.764 HD13 ' O ' ' A' ' 113' ' ' VAL . 4.4 mm -138.07 154.5 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.083 -1.011 . . . . 0.0 110.314 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.63 -0.12 2.92 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.487 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -155.08 155.35 33.92 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.381 -0.824 . . . . 0.0 109.072 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -74.39 -24.75 59.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.005 . . . . 0.0 109.912 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.528 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 1.0 OUTLIER -68.82 -14.52 63.08 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.135 -0.978 . . . . 0.0 109.144 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.585 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 10.2 mm-40 -87.09 4.1 43.51 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.767 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.673 HD23 HD11 ' A' ' 125' ' ' ILE . 9.2 mt -107.18 31.17 5.57 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.278 -0.889 . . . . 0.0 109.577 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 118' ' ' LYS . 1.6 mt-10 -79.27 138.08 37.63 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.044 -1.035 . . . . 0.0 109.903 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -46.0 -53.75 9.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.095 -1.003 . . . . 0.0 109.477 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ASP . . . . . 0.733 ' OD1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -60.78 -38.6 85.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.277 -0.89 . . . . 0.0 109.735 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.585 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 20.8 t80 -61.06 -48.18 82.94 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.208 -0.932 . . . . 0.0 109.157 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.673 HD11 HD23 ' A' ' 120' ' ' LEU . 2.0 mm -58.96 -21.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.562 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -82.24 -44.97 15.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.129 -0.982 . . . . 0.0 109.838 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.7 t -58.33 -30.94 67.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.246 -0.909 . . . . 0.0 109.842 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -85.24 -38.93 18.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.582 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.698 HD21 ' HB2' ' A' ' 77' ' ' ALA . 6.1 mt -68.2 -27.82 66.72 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.122 -0.986 . . . . 0.0 109.295 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.3 mttp . . . . . 0 N--CA 1.488 1.474 0 O-C-N 121.172 -0.955 . . . . 0.0 109.106 179.711 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.63 ' CB ' HG23 ' A' ' 35' ' ' THR . 23.1 mttp -128.77 124.06 34.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.466 -0.771 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.597 HD12 HG21 ' A' ' 36' ' ' ILE . 3.0 tp -107.59 130.32 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.379 -0.825 . . . . 0.0 109.476 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -102.86 60.89 0.79 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.148 -0.97 . . . . 0.0 109.451 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.711 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -45.52 -14.11 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.065 -1.022 . . . . 0.0 109.51 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 6' ' ' ASP . 4.0 mt-10 -55.53 -50.74 69.19 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.199 -0.938 . . . . 0.0 109.443 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.29 -58.19 6.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 109.383 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.596 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.3 m -57.05 -65.17 0.66 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 109.776 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.436 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 9.7 tmm_? -44.62 -57.68 3.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.981 -1.075 . . . . 0.0 109.959 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.64 -33.05 53.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.169 -0.957 . . . . 0.0 109.366 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.2 -39.69 25.03 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.75 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.667 ' CZ ' ' CG ' ' A' ' 61' ' ' PHE . 1.5 m-85 -50.27 -49.23 53.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.23 -0.919 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.516 ' N ' ' OD1' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -80.13 -17.42 52.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.099 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 16' ' ' LEU . 33.1 tp -70.61 -22.72 62.51 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.733 HG11 ' O ' ' A' ' 25' ' ' ILE . 4.5 m -92.0 -3.09 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.91 . . . . 0.0 109.529 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.653 ' CG ' HH11 ' A' ' 18' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.317 -0.865 . . . . 0.0 109.382 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.569 0.7 . . . . 0.0 110.405 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 24' ' ' VAL . 2.4 m -39.18 123.53 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.512 -0.742 . . . . 0.0 110.494 -179.294 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.733 ' O ' HG11 ' A' ' 17' ' ' VAL . 0.3 OUTLIER -63.09 -55.0 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.694 ' CE3' HG23 ' A' ' 28' ' ' THR . 17.7 p-90 -128.86 165.13 21.61 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.579 ' CG1' HG21 ' A' ' 24' ' ' VAL . 27.8 m -133.48 133.52 57.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.24 -0.912 . . . . 0.0 109.278 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.694 HG23 ' CE3' ' A' ' 26' ' ' TRP . 72.5 p -125.87 137.83 53.76 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.283 -0.885 . . . . 0.0 109.65 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.657 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.65 163.56 16.27 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 178.475 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.675 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -141.0 142.22 34.27 Favored 'General case' 0 C--N 1.294 -1.831 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.538 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.417 ' C ' ' O ' ' A' ' 30' ' ' ARG . 6.6 m-85 -42.76 98.55 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.486 -0.759 . . . . 0.0 109.887 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 30' ' ' ARG . 1.3 t0 -97.97 101.59 13.12 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 57.68 -120.18 20.12 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.076 -1.61 . . . . 0.0 109.076 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.67 22.94 15.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -1.06 . . . . 0.0 110.292 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.63 HG23 ' CB ' ' A' ' 4' ' ' LYS . 2.8 m -143.47 134.95 26.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.107 -0.996 . . . . 0.0 110.014 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.597 HG21 HD12 ' A' ' 5' ' ' ILE . 1.6 mp -84.44 110.27 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.302 -0.874 . . . . 0.0 108.969 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 m -135.8 158.58 73.78 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.277 -0.889 . . . . 0.0 109.662 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -50.74 135.78 42.23 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.754 2.303 . . . . 0.0 111.585 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.465 ' HA3' HH11 ' A' ' 30' ' ' ARG . . . -130.4 -22.96 1.04 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.627 ' OD1' ' NE2' ' A' ' 51' ' ' GLN . 1.8 m-20 -142.68 -178.35 5.74 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.492 -1.005 . . . . 0.0 109.425 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.597 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -163.22 -176.99 5.1 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.435 -0.79 . . . . 0.0 109.764 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.407 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -157.27 141.92 8.23 Favored Glycine 0 N--CA 1.489 2.174 0 C-N-CA 119.549 -1.31 . . . . 0.0 109.9 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.3 -8.8 18.03 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -157.52 174.83 14.78 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.574 ' CZ ' ' CE2' ' A' ' 48' ' ' PHE . 31.0 t80 -73.68 -10.64 59.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.277 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.631 ' HA ' HD11 ' A' ' 49' ' ' ILE . 46.0 mm-40 -75.61 -30.29 59.51 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.187 -0.946 . . . . 0.0 110.636 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.533 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -79.36 -4.0 48.87 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.609 -1.307 . . . . 0.0 110.044 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.583 ' CZ ' HD13 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -83.13 -51.51 7.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.835 -1.166 . . . . 0.0 110.193 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.756 ' N ' HD12 ' A' ' 49' ' ' ILE . 0.1 OUTLIER -63.03 -32.66 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 120.876 -1.14 . . . . 0.0 109.137 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.93 -21.5 60.87 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.627 ' NE2' ' OD1' ' A' ' 40' ' ' ASP . 28.9 mm-40 -96.46 -15.1 21.92 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.527 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.565 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 7.5 m -117.92 52.44 1.0 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.414 -0.804 . . . . 0.0 110.228 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 55' ' ' ASP . 23.3 p -72.48 166.87 21.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.911 -1.118 . . . . 0.0 109.266 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -70.47 12.21 0.27 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 109.768 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 53' ' ' THR . 5.9 m-20 -120.49 24.82 10.15 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.398 -0.814 . . . . 0.0 109.749 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.438 HG13 ' CD1' ' A' ' 81' ' ' TRP . 6.8 p -148.11 162.79 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.577 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.487 ' O ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -138.38 126.09 22.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.261 -0.899 . . . . 0.0 110.178 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.743 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.0 pp -172.85 173.81 3.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.165 -0.96 . . . . 0.0 110.0 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.56 ' O ' HG22 ' A' ' 28' ' ' THR . 0.6 OUTLIER -107.19 154.52 21.08 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.22 -0.925 . . . . 0.0 108.739 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.483 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -134.74 157.53 46.47 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.166 -0.959 . . . . 0.0 109.458 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.667 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 85.8 t80 -149.85 96.6 2.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.269 -0.895 . . . . 0.0 109.27 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.5 158.12 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.253 -0.904 . . . . 0.0 109.305 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -84.39 127.25 33.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.194 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -104.22 155.93 18.32 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 109.761 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.8 m -79.78 143.35 34.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.355 -0.841 . . . . 0.0 109.108 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.8 m . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.457 -0.777 . . . . 0.0 109.362 179.868 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.34 152.46 28.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.355 -0.84 . . . . 0.0 109.44 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.667 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 1.7 m-85 -134.17 126.46 29.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.411 -0.806 . . . . 0.0 109.683 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.64 159.32 43.0 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.794 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.572 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -113.08 155.84 24.19 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 120' ' ' LEU . 2.0 mt -138.06 135.68 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.915 -1.116 . . . . 0.0 109.121 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.3 m -95.93 120.24 35.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.565 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 64.9 t-105 -92.86 111.32 22.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.028 -1.045 . . . . 0.0 109.878 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -107.52 92.88 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.505 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -61.64 147.36 48.15 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.19 -14.1 60.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.31 -1.112 . . . . 0.0 109.582 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.59 37.02 1.41 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 109.492 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 83' ' ' GLY . 43.6 t -102.79 160.47 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.477 ' N ' HG12 ' A' ' 86' ' ' VAL . 14.0 m -91.64 -170.29 2.55 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.373 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -18.1 64.07 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 90' ' ' GLN . 8.0 mt -51.08 -69.79 0.1 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.15 -1.206 . . . . 0.0 109.5 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.552 ' N ' ' CD ' ' A' ' 90' ' ' GLN . 0.9 OUTLIER -44.61 -33.94 1.98 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 109.292 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.45 ' HA ' ' HE ' ' A' ' 91' ' ' ARG . 1.1 tpm_? -45.62 -61.69 1.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.693 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.7 -37.24 42.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.193 -0.942 . . . . 0.0 109.487 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.413 ' O ' ' C ' ' A' ' 94' ' ' THR . 0.1 OUTLIER -64.75 -66.31 0.56 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.943 . . . . 0.0 109.834 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.499 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 95.6 m -44.74 -40.68 6.22 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.25 -0.906 . . . . 0.0 109.562 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.489 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -51.12 -57.22 11.68 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 35.0 p -67.92 -47.99 67.2 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.957 -1.32 . . . . 0.0 110.909 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.59 ' OD2' HD13 ' A' ' 36' ' ' ILE . 9.6 t0 -69.66 -45.37 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.816 -1.177 . . . . 0.0 111.03 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.499 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -55.38 -24.26 28.87 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.774 -1.17 . . . . 0.0 108.604 -179.734 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.3 OUTLIER -67.23 -50.24 61.43 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.338 -0.851 . . . . 0.0 108.79 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 100' ' ' LEU . 10.4 mp -51.33 -54.67 24.01 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.292 -0.88 . . . . 0.0 109.499 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.467 HG22 HD11 ' A' ' 5' ' ' ILE . 31.2 t -48.94 -74.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.148 -0.97 . . . . 0.0 109.945 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 101' ' ' VAL . 32.8 mtmt -43.13 -48.96 6.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.152 -0.968 . . . . 0.0 109.681 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.58 -57.37 12.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.921 . . . . 0.0 110.045 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.783 ' O ' HG12 ' A' ' 104' ' ' VAL . 97.5 t -75.56 40.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 109.911 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.461 ' O ' HG12 ' A' ' 105' ' ' VAL . 2.2 t -138.23 113.04 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.098 -1.001 . . . . 0.0 109.863 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.621 ' O ' ' N ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -124.2 -30.24 3.47 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 9.3 m-20 -61.21 35.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.822 -0.549 . . . . 0.0 110.214 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.621 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -149.71 -178.06 6.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.066 -1.021 . . . . 0.0 110.135 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.96 -62.76 1.29 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.414 -0.804 . . . . 0.0 109.925 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.534 ' CB ' ' NZ ' ' A' ' 110' ' ' LYS . 5.6 ttpm? -147.4 173.9 12.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.22 -0.925 . . . . 0.0 109.6 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.489 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -104.62 155.43 18.85 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.932 . . . . 0.0 109.192 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -135.43 150.67 49.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.272 -0.893 . . . . 0.0 110.069 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.8 p -116.29 147.26 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 115' ' ' SER . 27.5 mm -138.5 156.56 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.188 -0.945 . . . . 0.0 110.375 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.403 ' O ' ' OG ' ' A' ' 115' ' ' SER . 0.3 OUTLIER -140.75 6.03 2.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.584 ' OD1' ' N ' ' A' ' 117' ' ' ARG . 43.3 t0 -150.14 155.36 39.67 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.866 . . . . 0.0 109.409 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.584 ' N ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -79.04 -28.39 43.23 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.197 -0.939 . . . . 0.0 110.047 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -73.99 -14.74 61.07 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.603 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -86.41 4.63 38.67 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -0.821 . . . . 0.0 109.744 -179.928 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.796 HD23 HD11 ' A' ' 125' ' ' ILE . 7.2 mt -114.12 29.48 7.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.362 -0.837 . . . . 0.0 109.652 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 122' ' ' GLU . 4.0 mm-40 -76.83 141.83 40.51 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.351 -0.843 . . . . 0.0 109.287 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 121' ' ' GLU . 1.3 mt-10 -41.31 -52.4 3.46 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.187 -0.945 . . . . 0.0 109.742 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.2 -10.88 45.81 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.307 -0.87 . . . . 0.0 110.868 -179.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.603 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 18.0 t80 -86.34 -48.81 8.15 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.737 -1.227 . . . . 0.0 109.359 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.796 HD11 HD23 ' A' ' 120' ' ' LEU . 4.1 mm -76.24 -20.56 15.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -73.34 -53.35 10.99 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.27 -0.894 . . . . 0.0 108.951 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.65 -18.66 65.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.315 -0.866 . . . . 0.0 109.315 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.404 ' CG ' ' O ' ' A' ' 124' ' ' PHE . 5.7 mm-40 -72.36 -43.09 64.53 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.191 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.1 mt -66.51 -36.39 82.59 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? . . . . . 0 C--N 1.303 -1.432 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.81 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 35' ' ' THR . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.724 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.621 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.423 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.587 ' O ' ' NE ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.804 ' O ' HG22 ' A' ' 24' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.709 HG22 ' O ' ' A' ' 42' ' ' GLY . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.688 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.621 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.771 ' OH ' HG23 ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.447 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.709 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.614 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.446 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.591 ' O ' HG23 ' A' ' 53' ' ' THR . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.2 mm-40 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.463 ' SG ' HD21 ' A' ' 120' ' ' LEU . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.521 ' HD2' ' H ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.553 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.825 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.633 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.825 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.714 ' HD3' HD13 ' A' ' 129' ' ' LEU . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.454 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.62 ' CG2' HD12 ' A' ' 114' ' ' ILE . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.441 HG23 ' CD2' ' A' ' 59' ' ' PHE . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 80' ' ' THR . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.525 ' N ' ' CD ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' THR . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.771 HG23 ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' ALA . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.415 ' OD2' HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 104' ' ' VAL . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.427 ' O ' HG12 ' A' ' 105' ' ' VAL . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.558 ' O ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.62 HD12 ' CG2' ' A' ' 79' ' ' ILE . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.661 ' H ' ' CD ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.714 HD13 ' HD3' ' A' ' 75' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -139.61 118.44 12.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.236 -0.915 . . . . 0.0 109.47 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.506 HG23 ' HG3' ' A' ' 7' ' ' LYS . 1.3 tt -113.84 147.21 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.522 -0.736 . . . . 0.0 109.653 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -94.37 63.0 2.97 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.218 -0.926 . . . . 0.0 109.111 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.746 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.49 -26.16 60.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 109.55 -179.705 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.87 -46.6 71.36 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.278 -0.889 . . . . 0.0 109.407 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -60.86 -68.12 0.34 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.947 . . . . 0.0 109.582 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.76 -58.9 2.79 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.164 -0.96 . . . . 0.0 109.859 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 8.5 ttt180 -44.41 -59.57 2.35 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.925 -1.109 . . . . 0.0 110.219 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.75 -37.0 65.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.937 . . . . 0.0 110.038 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.483 ' CB ' HG11 ' A' ' 27' ' ' VAL . . . -83.6 -19.17 36.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.096 -1.003 . . . . 0.0 110.117 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.505 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -72.62 -53.89 10.62 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.111 -0.993 . . . . 0.0 109.569 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.608 HD21 HH21 ' A' ' 18' ' ' ARG . 3.1 m120 -68.51 -25.68 65.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.221 -0.924 . . . . 0.0 109.547 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.64 -61.33 2.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.233 -0.917 . . . . 0.0 109.329 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 14' ' ' TYR . 21.4 m -51.84 -19.41 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 109.733 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.608 HH21 HD21 ' A' ' 15' ' ' ASN . 8.0 ttm180 . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.169 -0.957 . . . . 0.0 109.507 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.494 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.494 ' C ' ' O ' ' A' ' 23' ' ' ALA . 4.8 m 31.94 74.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.846 -0.534 . . . . 0.0 110.686 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.754 HG22 ' O ' ' A' ' 42' ' ' GLY . 6.3 tt -44.49 -38.4 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.089 -1.007 . . . . 0.0 108.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.753 ' CD1' HG23 ' A' ' 25' ' ' ILE . 43.5 p-90 -150.57 162.51 40.5 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.397 -0.814 . . . . 0.0 109.25 178.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.483 HG11 ' CB ' ' A' ' 13' ' ' ALA . 26.8 m -133.26 139.4 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 109.187 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.584 HG23 ' CE3' ' A' ' 26' ' ' TRP . 60.7 p -128.98 139.93 51.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.34 -0.85 . . . . 0.0 110.179 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.18 133.36 51.58 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 16.9 ptt180 -108.59 147.41 31.85 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.852 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.475 ' HH ' ' CG ' ' A' ' 97' ' ' ASP . 14.5 m-85 -47.55 98.66 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.565 -0.709 . . . . 0.0 109.766 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -96.02 101.97 13.7 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.7 -120.23 21.47 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.99 22.25 16.23 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.326 -1.103 . . . . 0.0 110.228 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.0 m -145.33 136.99 25.35 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.805 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.9 mp -81.62 114.35 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.221 -0.924 . . . . 0.0 108.979 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -135.46 152.0 75.7 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 109.717 -179.56 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 97.0 Cg_exo -33.12 145.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 122.971 2.447 . . . . 0.0 112.252 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -137.44 -36.45 0.17 Allowed Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.934 ' CG ' HE22 ' A' ' 51' ' ' GLN . 2.7 m-20 -142.67 -179.81 6.54 Favored 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.731 -0.864 . . . . 0.0 109.419 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.618 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -157.03 179.8 8.94 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.995 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.754 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.27 133.09 2.89 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.45 -3.04 24.52 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.82 175.97 12.92 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -42.42 70.55 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 120.677 -1.264 . . . . 0.0 108.946 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.41 ' N ' ' CD ' ' A' ' 46' ' ' GLN . 2.1 mp0 -43.09 -35.54 1.34 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.305 -0.872 . . . . 0.0 110.674 -179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.529 ' CD2' HE22 ' A' ' 41' ' ' GLN . 1.0 OUTLIER -62.95 -22.56 66.88 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.013 -1.054 . . . . 0.0 109.532 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.553 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -68.44 -23.97 64.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.202 -0.936 . . . . 0.0 108.718 179.489 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.522 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.4 mt -76.57 -54.02 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.582 -0.699 . . . . 0.0 109.927 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.455 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 13.1 tm0? -65.56 -2.94 3.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.934 HE22 ' CG ' ' A' ' 40' ' ' ASP . 26.8 mm-40 -106.13 -37.54 6.56 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.11 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.595 ' O ' HG23 ' A' ' 53' ' ' THR . 0.1 OUTLIER -49.32 132.43 20.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.287 -0.883 . . . . 0.0 109.644 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.595 HG23 ' O ' ' A' ' 52' ' ' CYS . 20.6 p -160.07 115.29 2.34 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.4 -0.813 . . . . 0.0 110.555 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.74 11.36 0.1 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.628 -0.67 . . . . 0.0 109.587 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.538 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -122.71 16.68 10.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.495 -0.753 . . . . 0.0 109.324 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.532 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -135.72 154.26 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.4 -0.813 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.728 ' H ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.59 131.73 43.52 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.355 -0.841 . . . . 0.0 109.519 -179.936 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.765 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.8 pp -172.69 172.39 4.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.974 -1.078 . . . . 0.0 110.317 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.567 ' N ' ' CD1' ' A' ' 59' ' ' PHE . 2.2 m-85 -106.01 153.96 21.29 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -135.83 156.9 48.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.02 -1.05 . . . . 0.0 109.556 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 53.9 t80 -148.19 97.57 2.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.358 -0.839 . . . . 0.0 109.21 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.503 ' O ' ' CE1' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -115.74 150.97 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -80.47 108.6 14.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.276 -0.89 . . . . 0.0 108.96 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CE1' ' O ' ' A' ' 62' ' ' VAL . 14.9 m-85 -86.72 155.76 20.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.324 -0.86 . . . . 0.0 109.805 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.55 161.04 28.19 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.298 -0.876 . . . . 0.0 108.848 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 0.0 109.466 -179.902 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.647 ' HD2' HD22 ' A' ' 129' ' ' LEU . 2.6 mmtp -104.59 154.98 19.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.846 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.582 ' O ' ' N ' ' A' ' 109' ' ' ALA . 84.3 m-85 -133.22 118.8 19.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.151 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.426 ' HB1' ' O ' ' A' ' 110' ' ' LYS . . . -144.36 167.18 23.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.139 -0.976 . . . . 0.0 111.024 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.436 ' HG ' ' N ' ' A' ' 79' ' ' ILE . 9.2 tp -111.87 151.64 28.87 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.568 HG23 HG12 ' A' ' 114' ' ' ILE . 22.1 mt -130.35 129.54 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.99 -1.069 . . . . 0.0 108.758 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.476 HG22 HD11 ' A' ' 82' ' ' ILE . 5.7 m -95.86 115.05 26.86 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.532 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 62.8 t-105 -92.97 111.23 22.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.101 -0.999 . . . . 0.0 109.651 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.476 HD11 HG22 ' A' ' 80' ' ' THR . 24.9 mm -104.1 93.19 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 108.906 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.59 137.6 39.7 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -79.55 53.22 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.286 -1.126 . . . . 0.0 109.653 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -141.22 -30.99 0.6 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.17 -0.956 . . . . 0.0 109.81 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.444 HG23 ' H ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -64.83 156.81 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.188 -0.945 . . . . 0.0 109.623 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.453 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 54.9 p -96.04 -127.89 0.14 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.363 -0.836 . . . . 0.0 109.587 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.453 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.17 -18.33 63.01 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.53 ' O ' ' CG ' ' A' ' 93' ' ' LYS . 3.4 mt -46.14 -48.9 17.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.971 -1.311 . . . . 0.0 109.934 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -66.03 -26.39 67.49 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.145 -0.972 . . . . 0.0 109.908 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -56.39 -67.2 0.32 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.966 -1.084 . . . . 0.0 110.188 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.77 -44.43 49.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.18 -0.95 . . . . 0.0 110.131 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 89' ' ' LEU . 12.3 mmtm -55.82 -65.19 0.64 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.208 -0.933 . . . . 0.0 110.102 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 8.0 m -50.78 -49.68 57.75 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.131 -0.981 . . . . 0.0 109.679 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -46.94 -61.1 4.58 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 m -63.91 -51.12 65.94 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.031 -1.276 . . . . 0.0 111.78 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -74.57 -39.76 62.07 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.725 -1.234 . . . . 0.0 111.784 -177.183 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.588 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -55.36 -26.36 40.65 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 120.585 -1.322 . . . . 0.0 108.642 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.45 -30.34 47.42 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 97' ' ' ASP . 2.0 mt -71.18 -64.57 0.89 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.439 -0.788 . . . . 0.0 109.339 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.603 HG13 ' N ' ' A' ' 102' ' ' LYS . 9.9 p -41.9 -45.46 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.209 -0.932 . . . . 0.0 110.008 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.603 ' N ' HG13 ' A' ' 101' ' ' VAL . 6.1 ttpt -65.99 -39.4 90.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.271 -0.893 . . . . 0.0 109.597 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.66 -51.27 70.11 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.251 -0.906 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.639 ' O ' HG12 ' A' ' 104' ' ' VAL . 40.2 t -77.64 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.099 -1.001 . . . . 0.0 109.954 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.507 HG12 ' O ' ' A' ' 102' ' ' LYS . 1.7 p -112.57 136.55 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.338 -0.851 . . . . 0.0 109.513 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -145.65 24.67 1.36 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.373 -0.829 . . . . 0.0 108.928 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.521 ' ND2' ' OD1' ' A' ' 15' ' ' ASN . 2.8 t-20 -135.39 -25.32 1.33 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.432 -0.792 . . . . 0.0 110.141 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.505 ' C ' ' CD1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -76.86 171.1 15.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.388 -179.561 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -117.79 -31.74 5.04 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.77 ' HE2' ' CE1' ' A' ' 112' ' ' PHE . 3.2 ttpm? -162.46 152.05 15.89 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.507 -0.746 . . . . 0.0 109.16 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -104.43 155.45 18.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.127 -0.983 . . . . 0.0 109.088 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.77 ' CE1' ' HE2' ' A' ' 110' ' ' LYS . 9.4 m-85 -133.88 156.44 48.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.366 -0.834 . . . . 0.0 109.819 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.765 ' O ' HG13 ' A' ' 113' ' ' VAL . 13.0 p -113.44 97.41 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.695 HG23 ' HB3' ' A' ' 119' ' ' GLU . 30.4 mm -100.32 142.44 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.228 -0.92 . . . . 0.0 109.888 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.1 m -141.1 15.6 2.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.308 -0.87 . . . . 0.0 109.548 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.9 155.34 46.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.034 -1.041 . . . . 0.0 110.124 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -69.71 -36.25 75.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 109.709 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -76.3 -17.36 59.48 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.695 ' HB3' HG23 ' A' ' 114' ' ' ILE . 15.3 mm-40 -83.25 -15.84 48.71 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.475 ' HG ' HG21 ' A' ' 114' ' ' ILE . 0.5 OUTLIER -103.44 30.95 4.62 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.736 ' CG ' ' H ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -74.54 -175.31 2.35 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.448 0.642 . . . . 0.0 110.367 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.476 ' C ' ' OE2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -84.06 -44.65 13.88 Favored 'General case' 0 C--N 1.295 -1.771 0 O-C-N 121.36 -0.838 . . . . 0.0 110.145 177.272 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -85.79 -44.89 12.11 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 114.884 1.438 . . . . 0.0 114.884 -175.521 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.736 ' H ' ' CG ' ' A' ' 121' ' ' GLU . 18.9 t80 -49.94 -40.79 44.79 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 119.874 -1.766 . . . . 0.0 108.93 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.573 ' H ' ' CD ' ' A' ' 121' ' ' GLU . 1.1 mm -78.21 -27.17 14.53 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.831 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -67.48 -45.66 75.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.981 -1.074 . . . . 0.0 109.719 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' SER . . . . . 0.534 ' O ' ' N ' ' A' ' 130' ' ' LYS . 0.8 OUTLIER -63.2 -66.51 0.53 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.488 ' CD ' ' CE2' ' A' ' 112' ' ' PHE . 24.0 pt-20 -41.97 -33.2 0.52 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.489 -0.757 . . . . 0.0 109.318 -178.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.647 HD22 ' HD2' ' A' ' 75' ' ' LYS . 4.8 mt -79.08 -32.17 44.64 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.111 -0.993 . . . . 0.0 109.056 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.534 ' N ' ' O ' ' A' ' 127' ' ' SER . 14.2 mttp . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.261 -0.9 . . . . 0.0 108.951 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.412 ' CG2' ' OD2' ' A' ' 97' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.475 ' CB ' HG23 ' A' ' 35' ' ' THR . 11.0 mmtm -133.49 121.79 22.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.38 -0.825 . . . . 0.0 109.314 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.461 HG23 ' H ' ' A' ' 7' ' ' LYS . 2.2 tp -107.44 136.18 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.408 -0.807 . . . . 0.0 109.747 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 8' ' ' GLU . 1.9 p-10 -97.84 41.84 1.11 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -0.891 . . . . 0.0 109.041 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.652 ' NZ ' HG13 ' A' ' 101' ' ' VAL . 1.3 mmtm -42.01 -18.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.346 -0.846 . . . . 0.0 109.898 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.5 mt-10 -51.96 -35.65 46.83 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.201 -0.937 . . . . 0.0 109.484 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.411 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -75.81 -63.67 1.25 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.863 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.65 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.49 -57.96 3.26 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.09 -1.006 . . . . 0.0 109.888 -179.439 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.65 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -44.16 -59.58 2.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.997 -1.064 . . . . 0.0 110.001 -179.098 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.9 -37.22 71.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.128 -0.983 . . . . 0.0 109.632 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.452 ' CB ' HG11 ' A' ' 27' ' ' VAL . . . -81.13 -11.13 59.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.12 -0.988 . . . . 0.0 109.852 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.476 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -81.88 -51.85 7.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.11 -0.994 . . . . 0.0 109.734 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 11' ' ' ARG . 0.1 OUTLIER -77.72 -11.25 59.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.247 -0.908 . . . . 0.0 109.64 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.479 ' C ' ' H ' ' A' ' 18' ' ' ARG . 58.3 tp -78.41 -50.06 12.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.207 -0.933 . . . . 0.0 109.34 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 m -57.87 -2.87 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.306 -0.871 . . . . 0.0 109.484 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.479 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.816 ' O ' HG12 ' A' ' 24' ' ' VAL . 55.7 t 53.02 57.16 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.269 -0.894 . . . . 0.0 109.482 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.79 HG23 ' CD1' ' A' ' 26' ' ' TRP . 6.9 tt -47.16 -36.45 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.906 -1.121 . . . . 0.0 108.865 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.79 ' CD1' HG23 ' A' ' 25' ' ' ILE . 57.9 p-90 -148.27 151.57 35.66 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.784 -1.197 . . . . 0.0 109.671 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.452 HG11 ' CB ' ' A' ' 13' ' ' ALA . 2.4 m -112.35 163.36 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.31 -0.869 . . . . 0.0 109.701 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.463 HG22 HD23 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -145.47 129.37 17.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.177 -0.952 . . . . 0.0 110.482 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.97 119.66 27.21 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 25.0 ptt180 -101.73 144.83 29.94 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -48.44 98.55 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.532 -0.73 . . . . 0.0 109.753 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -92.67 101.95 14.36 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.962 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.95 -119.28 15.55 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.094 -1.603 . . . . 0.0 109.094 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.34 24.95 12.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.546 -0.973 . . . . 0.0 110.146 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.475 HG23 ' CB ' ' A' ' 4' ' ' LYS . 11.4 m -146.36 132.59 19.46 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.151 -0.968 . . . . 0.0 109.982 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.741 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.5 mp -79.95 113.12 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.175 -0.953 . . . . 0.0 108.515 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.46 152.13 75.92 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.196 -0.94 . . . . 0.0 110.16 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_exo -34.78 141.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.903 2.402 . . . . 0.0 112.471 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.78 -37.88 0.28 Allowed Glycine 0 N--CA 1.488 2.167 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -143.54 -179.49 6.47 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.661 ' H ' ' CD ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -130.79 -165.32 1.54 Allowed 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 121.49 0.662 . . . . 0.0 109.92 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.725 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -139.36 101.61 0.32 Allowed Glycine 0 C--N 1.299 -1.497 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.531 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -136.9 50.99 1.99 Allowed 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.531 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 3.6 m-20 155.63 106.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.68 ' OH ' ' HE1' ' A' ' 64' ' ' PHE . 23.0 t80 -53.78 -14.69 1.0 Allowed 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.403 ' N ' ' C ' ' A' ' 44' ' ' ASP . 43.5 mm-40 -85.15 -40.73 16.4 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.012 -1.055 . . . . 0.0 109.893 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.4 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -61.66 -37.15 82.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.872 . . . . 0.0 110.334 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.623 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -59.12 -47.68 84.37 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.849 -1.157 . . . . 0.0 108.468 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.53 ' N ' ' CG ' ' A' ' 48' ' ' PHE . 1.7 mt -47.09 -43.72 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.396 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.9 pp0? -85.77 -10.06 56.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.95 -1.094 . . . . 0.0 110.481 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 47' ' ' HIS . 6.9 mm-40 -86.95 8.15 24.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.96 -1.088 . . . . 0.0 109.771 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.581 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 4.8 p -130.7 55.09 1.85 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.341 -0.849 . . . . 0.0 109.477 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.554 ' C ' ' H ' ' A' ' 55' ' ' ASP . 9.5 p -73.45 159.48 33.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -0.945 . . . . 0.0 109.854 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.17 8.72 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.835 . . . . 0.0 110.156 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.554 ' H ' ' C ' ' A' ' 53' ' ' THR . 44.4 m-20 -116.84 21.8 13.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 109.57 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.524 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.2 OUTLIER -144.7 157.69 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.209 -0.932 . . . . 0.0 109.772 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.664 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -136.23 116.44 13.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.403 -0.81 . . . . 0.0 109.225 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.692 ' C ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -159.68 175.47 13.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.961 -1.087 . . . . 0.0 111.125 -179.357 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.709 ' HB3' HD11 ' A' ' 78' ' ' LEU . 3.5 m-85 -109.84 151.4 27.07 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.899 ' O ' HD12 ' A' ' 78' ' ' LEU . . . -134.37 154.61 51.26 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.896 -1.128 . . . . 0.0 109.349 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.442 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 47.3 t80 -148.8 99.14 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.076 -1.015 . . . . 0.0 108.926 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -118.86 152.66 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.382 -0.824 . . . . 0.0 108.976 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.476 HH11 ' HG3' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -84.47 123.37 30.19 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.403 -0.811 . . . . 0.0 109.053 179.461 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.68 ' HE1' ' OH ' ' A' ' 45' ' ' TYR . 94.1 m-85 -108.14 156.23 19.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.415 -0.803 . . . . 0.0 109.356 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.505 HG22 ' N ' ' A' ' 66' ' ' THR . 98.2 m -78.49 161.01 27.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.153 -0.967 . . . . 0.0 109.12 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.505 ' N ' HG22 ' A' ' 65' ' ' THR . 13.6 t . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.383 -0.823 . . . . 0.0 109.454 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.643 ' HD2' HD22 ' A' ' 129' ' ' LEU . 5.0 mmtm -105.86 143.62 33.75 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.325 -0.859 . . . . 0.0 109.71 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.419 ' O ' ' N ' ' A' ' 109' ' ' ALA . 90.9 m-85 -133.53 117.74 17.48 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.362 -0.836 . . . . 0.0 109.121 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.571 ' HB1' ' O ' ' A' ' 110' ' ' LYS . . . -144.38 167.74 21.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.018 -1.051 . . . . 0.0 111.3 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.899 HD12 ' O ' ' A' ' 60' ' ' ALA . 25.1 tp -114.16 156.48 24.16 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.497 HD11 HD12 ' A' ' 125' ' ' ILE . 6.6 mt -136.23 130.85 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.101 -0.999 . . . . 0.0 108.924 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.542 HG22 HD11 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -95.84 114.58 26.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.186 -0.946 . . . . 0.0 109.84 -179.568 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.673 ' C ' HD13 ' A' ' 82' ' ' ILE . 65.5 t-105 -93.35 112.38 24.28 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.579 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.673 HD13 ' C ' ' A' ' 81' ' ' TRP . 0.9 OUTLIER -114.81 93.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.463 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -48.21 156.39 1.12 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.54 -7.39 38.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -1.14 . . . . 0.0 109.698 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -102.9 21.11 16.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.227 -0.921 . . . . 0.0 109.583 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.878 HG12 ' H ' ' A' ' 87' ' ' SER . 4.8 t -86.28 -141.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.255 -0.903 . . . . 0.0 109.467 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.878 ' H ' HG12 ' A' ' 86' ' ' VAL . 10.0 m -150.27 -146.45 0.2 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.164 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.468 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -83.92 -17.28 65.76 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 90' ' ' GLN . 6.1 mp -46.5 -69.88 0.12 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.178 -1.189 . . . . 0.0 109.802 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.566 ' N ' ' OE1' ' A' ' 90' ' ' GLN . 3.3 mp0 -44.55 -29.65 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.121 -0.987 . . . . 0.0 109.229 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.468 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER -54.37 -64.5 0.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.12 -0.987 . . . . 0.0 109.737 -179.659 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 -44.11 38.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.161 -0.962 . . . . 0.0 109.707 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.35 -65.95 0.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.227 -0.921 . . . . 0.0 110.069 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.406 ' CB ' ' O ' ' A' ' 90' ' ' GLN . 2.1 m -51.86 -54.44 29.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.155 -0.966 . . . . 0.0 109.216 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.41 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.96 -62.84 2.5 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 p -64.58 -50.32 67.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.184 -1.186 . . . . 0.0 111.164 -178.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.435 ' HA ' HD12 ' A' ' 100' ' ' LEU . 2.9 m-20 -66.46 -40.2 89.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.782 -1.199 . . . . 0.0 111.693 -177.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.62 -24.52 65.57 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 120.628 -1.295 . . . . 0.0 109.119 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -77.69 -39.42 44.82 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' A' ' 101' ' ' VAL . 11.6 mt -64.38 -61.46 2.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.404 -0.81 . . . . 0.0 109.044 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.652 HG13 ' NZ ' ' A' ' 7' ' ' LYS . 42.7 t -38.88 -55.83 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 110.262 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 103' ' ' GLU . 76.9 tttt -65.39 -43.56 90.28 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.105 -0.997 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.425 ' C ' ' O ' ' A' ' 102' ' ' LYS . 1.4 tt0 -36.58 -33.64 0.05 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.487 -0.758 . . . . 0.0 111.293 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.755 HG22 ' O ' ' A' ' 104' ' ' VAL . 10.9 p -127.51 34.91 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.107 -0.996 . . . . 0.0 110.839 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.509 ' O ' ' CG1' ' A' ' 105' ' ' VAL . 0.6 OUTLIER -115.07 119.9 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.93 . . . . 0.0 109.018 179.063 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.04 -27.58 1.82 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.248 -0.908 . . . . 0.0 109.388 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -51.89 -34.51 41.57 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.301 -0.874 . . . . 0.0 109.289 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.412 ' CE1' HG13 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -70.12 -176.49 1.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.156 -0.965 . . . . 0.0 109.782 179.941 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -125.01 -29.41 3.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.521 -0.737 . . . . 0.0 109.235 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 0.2 OUTLIER -159.16 140.69 13.19 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.0 109.348 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.655 ' H ' ' CD ' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -105.01 151.12 24.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.27 -0.894 . . . . 0.0 109.14 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -136.03 157.08 47.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.283 -0.886 . . . . 0.0 110.249 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.4 104.37 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.634 HG21 ' HG ' ' A' ' 120' ' ' LEU . 38.5 mm -97.83 151.43 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.184 -0.947 . . . . 0.0 109.816 -179.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.54 5.51 2.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.351 -0.843 . . . . 0.0 109.257 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -135.21 154.58 51.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.578 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -69.52 -42.37 74.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 109.739 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -75.59 -4.18 38.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.153 -0.967 . . . . 0.0 109.294 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.623 ' HB3' HG23 ' A' ' 114' ' ' ILE . 9.9 mm-40 -86.4 0.54 53.84 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.248 -0.907 . . . . 0.0 109.618 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.634 ' HG ' HG21 ' A' ' 114' ' ' ILE . 5.1 mt -104.84 14.58 29.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.278 -0.889 . . . . 0.0 109.041 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -68.71 140.48 55.4 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.496 -0.752 . . . . 0.0 109.675 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.37 -53.02 57.18 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.875 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.78 69.24 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.173 -0.955 . . . . 0.0 109.692 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CE1' ' OE2' ' A' ' 119' ' ' GLU . 78.8 t80 -63.15 -47.71 81.55 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 122.008 0.909 . . . . 0.0 108.977 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.497 HD12 HD11 ' A' ' 79' ' ' ILE . 1.3 mm -74.4 -23.59 18.33 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.58 -55.52 17.2 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.341 -0.85 . . . . 0.0 109.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -23.22 65.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.14 -39.75 17.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.643 HD22 ' HD2' ' A' ' 75' ' ' LYS . 2.8 mt -69.86 -24.1 63.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.27 -0.894 . . . . 0.0 108.923 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.303 -1.413 0 O-C-N 121.281 -0.887 . . . . 0.0 108.678 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.567 HG21 ' OD1' ' A' ' 97' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.438 ' HB3' HG23 ' A' ' 35' ' ' THR . 0.3 OUTLIER -133.63 129.34 36.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.391 -0.818 . . . . 0.0 109.452 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.594 ' HB ' HD13 ' A' ' 100' ' ' LEU . 3.3 tp -107.53 135.26 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.835 . . . . 0.0 109.692 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.538 ' O ' ' N ' ' A' ' 8' ' ' GLU . 83.8 m-20 -98.1 49.12 1.0 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.443 ' CE ' ' O ' ' A' ' 104' ' ' VAL . 0.1 OUTLIER -40.44 -24.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.459 -0.776 . . . . 0.0 109.804 -179.409 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -47.49 -39.31 15.68 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.148 -0.97 . . . . 0.0 109.046 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.75 3.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.329 -0.857 . . . . 0.0 109.399 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -52.34 -69.46 0.11 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.124 -0.985 . . . . 0.0 109.536 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.407 ' C ' ' O ' ' A' ' 10' ' ' CYS . 19.2 ttt180 -44.3 -57.64 3.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.858 -1.151 . . . . 0.0 109.378 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.6 -52.77 53.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -19.17 65.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.408 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.65 ' CE2' ' CE1' ' A' ' 61' ' ' PHE . 0.2 OUTLIER -73.72 -56.3 5.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.373 -0.829 . . . . 0.0 109.721 -179.497 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -77.77 -17.88 57.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.332 -0.855 . . . . 0.0 109.918 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.03 -39.27 86.98 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.125 -0.984 . . . . 0.0 109.356 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.525 HG22 ' O ' ' A' ' 14' ' ' TYR . 16.0 m -70.98 -4.57 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.182 -0.949 . . . . 0.0 109.511 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.24 -0.912 . . . . 0.0 109.404 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.284 0.564 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.551 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -105.67 119.09 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.407 -0.808 . . . . 0.0 109.554 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.814 HG22 ' O ' ' A' ' 42' ' ' GLY . 9.9 tt -48.26 -39.79 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.023 -1.048 . . . . 0.0 108.946 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.698 ' CD1' HG23 ' A' ' 25' ' ' ILE . 34.5 p-90 -156.24 150.68 25.67 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.872 -1.143 . . . . 0.0 110.371 178.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -116.05 152.39 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.445 -0.785 . . . . 0.0 109.479 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.545 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 5.9 p -129.76 135.56 48.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.442 -0.786 . . . . 0.0 110.035 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.435 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -124.15 119.15 28.59 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -100.34 147.79 25.41 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.634 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.781 ' OH ' HG23 ' A' ' 94' ' ' THR . 12.3 m-85 -49.49 98.97 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.552 -0.718 . . . . 0.0 110.113 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.71 101.54 13.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.09 -121.0 23.39 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.22 22.09 16.43 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.392 -1.063 . . . . 0.0 110.081 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.438 HG23 ' HB3' ' A' ' 4' ' ' LYS . 24.0 m -142.72 132.36 23.88 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.28 -0.888 . . . . 0.0 110.042 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.463 ' H ' HD12 ' A' ' 36' ' ' ILE . 4.5 mp -79.12 114.98 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.349 -0.844 . . . . 0.0 108.956 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -135.55 151.88 75.33 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.389 -0.819 . . . . 0.0 109.804 -179.322 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.412 ' C ' ' O ' ' A' ' 37' ' ' VAL . 90.3 Cg_exo -34.57 149.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.653 2.236 . . . . 0.0 111.744 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -136.53 -44.35 0.09 OUTLIER Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.979 ' CG ' HE22 ' A' ' 51' ' ' GLN . 0.7 OUTLIER -143.02 -178.86 6.04 Favored 'General case' 0 C--N 1.294 -1.808 0 O-C-N 121.672 -0.899 . . . . 0.0 109.157 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.607 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -144.85 -166.97 2.54 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.441 -0.787 . . . . 0.0 109.789 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.814 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -166.82 134.45 3.28 Favored Glycine 0 N--CA 1.487 2.051 0 N-CA-C 109.654 -1.379 . . . . 0.0 109.654 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.14 -5.55 19.27 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -158.2 176.11 12.91 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.505 ' CE2' ' CE2' ' A' ' 48' ' ' PHE . 1.6 t80 -73.79 -44.74 55.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.012 -1.055 . . . . 0.0 109.55 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 45' ' ' TYR . 9.9 mm100 -42.29 -37.89 1.65 Allowed 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.263 -0.898 . . . . 0.0 110.274 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -60.99 -43.67 98.51 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.061 -1.024 . . . . 0.0 109.781 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.619 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -49.47 -33.99 15.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.133 -0.979 . . . . 0.0 108.707 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.428 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.7 mt -64.36 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.419 -0.8 . . . . 0.0 111.203 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.554 ' NE2' ' O ' ' A' ' 50' ' ' GLN . 2.6 tm0? -85.72 -13.63 47.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.658 -1.276 . . . . 0.0 107.951 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.979 HE22 ' CG ' ' A' ' 40' ' ' ASP . 15.1 mm-40 -96.52 -6.56 36.75 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.583 -178.692 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.57 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 16.8 p -123.37 54.08 1.29 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.416 -0.803 . . . . 0.0 110.317 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.449 ' C ' ' H ' ' A' ' 55' ' ' ASP . 40.9 p -75.48 155.1 36.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.856 -1.152 . . . . 0.0 109.42 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 p30 -71.77 12.58 0.36 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.768 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.449 ' H ' ' C ' ' A' ' 53' ' ' THR . 13.0 t70 -97.67 -0.19 46.01 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.171 -0.955 . . . . 0.0 110.169 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.514 HG13 ' N ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.41 176.07 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 120.909 -1.119 . . . . 0.0 110.634 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.761 ' NE ' HG11 ' A' ' 86' ' ' VAL . 5.5 ptp180 -138.96 134.75 33.56 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.772 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.5 pp -168.6 172.34 8.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.369 -0.832 . . . . 0.0 109.172 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -105.44 152.73 22.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -0.981 . . . . 0.0 109.282 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -130.17 153.56 48.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.418 -0.801 . . . . 0.0 108.998 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.65 ' CE1' ' CE2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -136.78 107.76 6.7 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.395 -0.815 . . . . 0.0 109.038 -179.583 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.416 ' HB ' ' HB3' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -133.1 143.32 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.393 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -83.12 115.89 22.09 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -93.76 155.72 17.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.232 -0.917 . . . . 0.0 110.171 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.57 149.16 34.88 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.505 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 109.547 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HE2' ' HA ' ' A' ' 66' ' ' THR . 8.2 mttm -105.02 150.55 24.86 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.35 -0.844 . . . . 0.0 109.673 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.553 ' O ' ' N ' ' A' ' 109' ' ' ALA . 89.1 m-85 -133.36 117.81 17.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.44 -0.788 . . . . 0.0 109.119 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.71 165.14 28.49 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.973 -1.079 . . . . 0.0 111.456 -178.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 79' ' ' ILE . 11.7 tp -108.89 145.72 34.91 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 114' ' ' ILE . 19.6 mt -131.33 141.44 45.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 120.85 -1.156 . . . . 0.0 108.846 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.0 m -112.62 124.83 53.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.063 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.564 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 60.8 t-105 -96.83 113.34 24.88 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.989 -1.069 . . . . 0.0 109.832 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mm -111.21 93.25 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -74.58 162.79 54.19 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 -179.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -110.46 66.97 0.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.627 -0.926 . . . . 0.0 109.689 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.448 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.2 t0 -169.41 -46.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.218 -0.926 . . . . 0.0 109.552 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.761 HG11 ' NE ' ' A' ' 57' ' ' ARG . 7.4 p -41.62 157.49 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.291 -0.881 . . . . 0.0 109.951 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.459 ' N ' HG22 ' A' ' 86' ' ' VAL . 30.1 p -61.09 173.55 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.414 -0.804 . . . . 0.0 109.971 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.38 -21.49 56.49 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.63 -69.77 0.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.122 -1.222 . . . . 0.0 110.017 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 84.1 mm-40 -49.14 -22.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.81 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 1.7 ttp180 -55.85 -44.13 77.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.808 -1.183 . . . . 0.0 109.436 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.83 -35.66 62.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.234 -0.916 . . . . 0.0 109.894 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.408 ' O ' ' C ' ' A' ' 94' ' ' THR . 10.6 mmmt -74.71 -48.44 25.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -0.919 . . . . 0.0 109.358 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.781 HG23 ' OH ' ' A' ' 31' ' ' TYR . 35.3 m -45.2 -59.5 2.6 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.348 -0.845 . . . . 0.0 109.422 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.73 -59.99 4.03 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 p -63.21 -51.45 66.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.986 -1.302 . . . . 0.0 110.521 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.567 ' OD1' HG21 ' A' ' 3' ' ' THR . 7.4 m-20 -58.45 -45.87 87.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.016 -1.052 . . . . 0.0 110.631 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -51.22 -31.16 19.61 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.847 -1.158 . . . . 0.0 108.24 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.44 -41.18 96.79 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.594 HD13 ' HB ' ' A' ' 5' ' ' ILE . 95.0 mt -48.12 -57.97 5.13 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.536 ' C ' ' H ' ' A' ' 103' ' ' GLU . 4.5 t -56.47 -50.72 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -65.02 7.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.536 ' H ' ' C ' ' A' ' 101' ' ' VAL . 3.0 tt0 -99.77 -44.55 6.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -0.792 . . . . 0.0 109.368 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.781 ' O ' HG12 ' A' ' 104' ' ' VAL . 53.4 t -123.02 62.93 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.439 -0.788 . . . . 0.0 109.863 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.622 HG13 ' O ' ' A' ' 105' ' ' VAL . 4.1 p -132.63 115.22 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.999 -1.063 . . . . 0.0 110.361 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.611 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.9 OUTLIER -125.2 -36.54 2.5 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.181 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.472 ' O ' ' CZ ' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -60.84 32.05 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.928 -0.482 . . . . 0.0 110.245 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.611 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -139.43 139.19 37.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 0.0 109.085 179.475 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -78.84 -35.58 43.78 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.172 -0.955 . . . . 0.0 109.41 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -162.65 157.72 22.24 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.27 -0.894 . . . . 0.0 109.456 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.73 156.45 17.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 108.922 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -139.14 154.92 48.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.136 -0.978 . . . . 0.0 110.104 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.923 ' O ' HD13 ' A' ' 114' ' ' ILE . 6.7 p -119.5 157.76 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.923 HD13 ' O ' ' A' ' 113' ' ' VAL . 2.4 mm -136.33 148.23 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.183 -0.948 . . . . 0.0 109.826 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.53 -3.92 2.97 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.434 ' O ' ' N ' ' A' ' 119' ' ' GLU . 0.1 OUTLIER -157.76 133.61 9.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.298 -0.876 . . . . 0.0 109.51 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.415 ' C ' ' O ' ' A' ' 116' ' ' ASP . 25.4 ttp180 -44.25 -25.37 0.23 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.254 -0.903 . . . . 0.0 109.625 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 116' ' ' ASP . 16.3 tttt -75.82 -18.56 59.43 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.174 -0.954 . . . . 0.0 109.359 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 59.4 mt-10 -86.28 -3.38 58.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.335 -0.853 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.613 HD13 ' CE1' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -105.27 31.41 4.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.176 -0.953 . . . . 0.0 108.866 -179.728 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -83.04 155.1 24.09 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.509 -0.744 . . . . 0.0 109.783 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.15 -50.77 60.05 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.112 -0.993 . . . . 0.0 109.44 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.3 -15.3 9.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.891 . . . . 0.0 109.936 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.608 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 15.0 t80 -84.8 -49.28 8.57 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 0.0 109.184 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.542 ' CG2' HD12 ' A' ' 129' ' ' LEU . 3.0 mt -77.99 -11.88 13.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.802 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.14 -55.86 5.07 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.346 -0.846 . . . . 0.0 108.87 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -17.54 64.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.264 -0.897 . . . . 0.0 109.461 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.439 ' CA ' ' OE1' ' A' ' 128' ' ' GLU . 0.1 OUTLIER -84.74 -40.14 17.64 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.336 -0.852 . . . . 0.0 109.364 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.542 HD12 ' CG2' ' A' ' 125' ' ' ILE . 2.5 mt -79.24 -7.97 58.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.29 -0.881 . . . . 0.0 109.724 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.05 -1.031 . . . . 0.0 108.942 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.3 0.571 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB3' HG23 ' A' ' 35' ' ' THR . 4.7 mmtp -136.73 118.61 15.19 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.0 109.427 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.763 ' CD1' HG22 ' A' ' 101' ' ' VAL . 0.9 OUTLIER -107.07 142.29 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.304 -0.873 . . . . 0.0 109.895 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.442 ' O ' ' C ' ' A' ' 7' ' ' LYS . 9.7 m-20 -90.25 44.5 1.2 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.301 -0.874 . . . . 0.0 108.974 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -38.68 -31.13 0.05 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.613 -0.679 . . . . 0.0 110.336 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' A' ' 6' ' ' ASP . 31.4 mt-10 -55.06 -51.22 67.03 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.22 -0.925 . . . . 0.0 110.307 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.96 -69.38 0.18 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.131 -0.981 . . . . 0.0 110.368 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -44.74 -57.89 3.42 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.218 -0.926 . . . . 0.0 110.465 -179.168 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.427 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 19.3 ttt180 -44.99 -58.54 3.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.93 -1.106 . . . . 0.0 110.266 -178.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.06 -46.42 82.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.218 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.402 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -77.39 -10.54 59.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.046 -1.034 . . . . 0.0 110.348 -179.19 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.5 m-85 -81.31 -54.2 5.68 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.427 ' OD1' ' O ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -75.99 -14.41 60.23 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.188 -0.945 . . . . 0.0 109.461 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' A' ' 18' ' ' ARG . 5.2 tt -73.48 -51.48 16.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.379 -0.825 . . . . 0.0 109.474 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.589 ' O ' HG22 ' A' ' 17' ' ' VAL . 3.3 p -55.37 -4.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.206 -0.934 . . . . 0.0 109.524 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.303 -1.418 0 O-C-N 121.303 -0.873 . . . . 0.0 109.453 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.34 0.591 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.796 ' O ' HG12 ' A' ' 24' ' ' VAL . 75.7 t 47.24 52.28 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.162 -0.961 . . . . 0.0 109.365 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.906 HG23 ' CD1' ' A' ' 26' ' ' TRP . 12.8 tt -46.26 -29.78 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 120.824 -1.172 . . . . 0.0 108.575 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.906 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.2 p-90 -156.17 150.94 26.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.879 -1.138 . . . . 0.0 110.076 177.51 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -113.24 144.84 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.535 -0.728 . . . . 0.0 109.797 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 59' ' ' PHE . 18.4 p -138.11 132.73 32.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.42 -0.8 . . . . 0.0 109.77 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.24 145.15 47.31 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.46 ' O ' ' N ' ' A' ' 32' ' ' ASP . 24.7 ptt180 -119.49 141.29 49.31 Favored 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 119.765 -0.774 . . . . 0.0 109.95 -178.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.45 ' CD1' ' NE2' ' A' ' 90' ' ' GLN . 0.6 OUTLIER -41.28 98.44 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.718 -0.614 . . . . 0.0 109.783 -179.422 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -91.47 101.99 14.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.884 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 54.11 -116.51 6.31 Favored Glycine 0 N--CA 1.487 2.087 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.52 25.3 11.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.391 -1.064 . . . . 0.0 110.211 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.409 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.7 m -146.31 133.91 20.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.193 -0.942 . . . . 0.0 109.816 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.1 mp -81.72 111.98 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.031 -1.043 . . . . 0.0 108.73 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.45 152.49 76.6 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.347 -0.846 . . . . 0.0 109.977 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -39.16 140.44 0.48 Allowed 'Trans proline' 0 C--N 1.311 -1.409 0 C-N-CA 122.659 2.239 . . . . 0.0 112.249 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.18 -33.49 0.36 Allowed Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.535 ' CB ' HE22 ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.12 -177.93 5.59 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.619 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -138.44 -176.94 4.64 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-O 121.821 0.82 . . . . 0.0 110.387 -179.826 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.633 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -119.66 83.71 0.36 Allowed Glycine 0 N--CA 1.479 1.556 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.607 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -104.71 56.38 0.7 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.643 -0.916 . . . . 0.0 108.53 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.607 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 33.5 t0 120.21 140.84 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -179.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -56.86 -47.36 80.6 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.067 -1.021 . . . . 0.0 108.462 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -53.27 -34.87 59.05 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.345 -0.847 . . . . 0.0 109.416 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.21 -28.95 29.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.0 108.896 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.597 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.24 -34.98 75.66 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.938 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.43 HG12 ' CE2' ' A' ' 48' ' ' PHE . 4.5 mt -76.29 -13.97 14.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.222 -0.924 . . . . 0.0 109.553 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -87.67 -50.41 6.51 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.105 -0.997 . . . . 0.0 109.411 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.535 HE22 ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -108.07 55.97 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.64 -0.662 . . . . 0.0 111.145 -178.183 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.1 t -162.32 62.66 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.082 -1.011 . . . . 0.0 109.184 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.583 ' O ' ' N ' ' A' ' 55' ' ' ASP . 2.5 p -87.54 154.68 20.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.404 -0.81 . . . . 0.0 109.916 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -46.14 -11.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.856 . . . . 0.0 109.652 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 53' ' ' THR . 1.9 t70 -93.27 35.37 1.09 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.202 -0.936 . . . . 0.0 109.403 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.581 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 53.3 t -145.4 145.3 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.282 -0.886 . . . . 0.0 109.45 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.654 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.51 122.98 27.08 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.48 -0.762 . . . . 0.0 109.68 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.606 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.84 -170.93 0.71 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.934 -1.104 . . . . 0.0 110.718 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.623 ' N ' ' CD1' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -118.32 153.61 33.69 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.213 -0.929 . . . . 0.0 109.145 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -136.31 156.35 48.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.791 -1.193 . . . . 0.0 109.309 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -149.56 103.35 3.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.16 -0.962 . . . . 0.0 109.375 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -118.37 154.37 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.241 -0.912 . . . . 0.0 109.602 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.582 ' NH2' ' O ' ' A' ' 17' ' ' VAL . 14.4 ttp180 -84.61 130.73 34.69 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -118.26 157.1 27.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.439 -0.788 . . . . 0.0 109.83 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.58 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . 8.7 t -97.0 140.96 30.75 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.314 -0.866 . . . . 0.0 109.044 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.4 -0.813 . . . . 0.0 109.614 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.0 p . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.58 ' NZ ' ' O ' ' A' ' 65' ' ' THR . 4.2 pttm -107.32 130.93 54.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.364 -0.835 . . . . 0.0 109.215 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.518 ' O ' ' N ' ' A' ' 109' ' ' ALA . 98.9 m-85 -103.82 129.3 51.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 110.275 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.57 161.95 37.82 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.126 -0.984 . . . . 0.0 111.241 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.8 157.44 25.56 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.9 mt -137.55 143.38 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 120.843 -1.161 . . . . 0.0 109.309 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.596 ' N ' ' O ' ' A' ' 112' ' ' PHE . 0.2 OUTLIER -100.82 114.83 28.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.162 -0.961 . . . . 0.0 109.03 179.636 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.597 ' CH2' ' O ' ' A' ' 115' ' ' SER . 73.5 t-105 -92.81 110.49 21.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.142 -0.973 . . . . 0.0 109.785 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.463 ' O ' ' OG ' ' A' ' 115' ' ' SER . 8.1 mm -114.88 92.5 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.03 161.09 0.05 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -88.36 -20.27 25.55 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -1.109 . . . . 0.0 109.457 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.49 41.46 1.23 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 109.505 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.514 HG12 ' N ' ' A' ' 87' ' ' SER . 52.0 t -96.83 161.98 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.228 -0.92 . . . . 0.0 109.732 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.514 ' N ' HG12 ' A' ' 86' ' ' VAL . 7.9 t -95.32 -162.47 0.95 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.253 -0.904 . . . . 0.0 109.42 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.06 -18.12 63.69 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.5 mt -46.69 -60.86 2.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.912 -1.346 . . . . 0.0 109.79 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.45 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 22.3 mm-40 -56.8 -30.76 64.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.006 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -50.93 -62.32 1.68 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.924 -1.11 . . . . 0.0 109.916 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.99 -44.04 15.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.161 -0.962 . . . . 0.0 110.014 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.401 ' O ' ' OH ' ' A' ' 31' ' ' TYR . 21.3 mtpt -58.43 -58.93 6.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.207 -0.933 . . . . 0.0 110.007 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.442 ' OG1' ' CD ' ' A' ' 90' ' ' GLN . 2.1 m -57.19 -40.82 78.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.111 -0.993 . . . . 0.0 109.487 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -43.72 -59.61 3.67 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.164 -1.175 . . . . 0.0 110.164 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.9 p -63.8 -42.88 97.63 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.072 -1.252 . . . . 0.0 110.845 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.0 -44.18 90.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.852 -1.155 . . . . 0.0 111.192 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -26.56 45.88 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.683 -1.261 . . . . 0.0 108.899 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -50.78 48.67 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.431 -0.793 . . . . 0.0 109.275 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.577 ' N ' HD12 ' A' ' 100' ' ' LEU . 8.5 mp -57.3 -59.49 5.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.763 HG22 ' CD1' ' A' ' 5' ' ' ILE . 21.8 t -44.46 -69.18 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.847 . . . . 0.0 109.409 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 ttpp -48.61 -47.79 39.74 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.466 -0.771 . . . . 0.0 110.046 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.86 -31.55 71.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 111.013 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.7 p -106.28 13.71 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.096 -1.003 . . . . 0.0 110.747 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.493 ' O ' ' CG1' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -108.39 124.43 64.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.102 -0.999 . . . . 0.0 109.829 179.81 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.648 ' C ' ' H ' ' A' ' 108' ' ' PHE . 5.7 mp0 -126.51 -30.21 2.86 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -62.39 29.27 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.537 -0.727 . . . . 0.0 109.93 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.648 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -141.95 160.85 39.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.153 -0.967 . . . . 0.0 109.238 179.502 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -95.66 -37.97 10.58 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.824 . . . . 0.0 109.609 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -158.29 159.83 36.38 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 109.438 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.75 160.48 14.94 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 109.172 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.596 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.9 m-85 -138.54 149.71 45.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.286 -0.884 . . . . 0.0 109.875 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.403 ' HA ' ' HG1' ' A' ' 80' ' ' THR . 58.6 t -114.67 118.73 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.525 -0.734 . . . . 0.0 109.036 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.497 HG23 ' OE2' ' A' ' 119' ' ' GLU . 7.2 mt -138.55 158.62 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.0 110.289 -179.412 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.597 ' O ' ' CH2' ' A' ' 81' ' ' TRP . 11.2 t -134.1 -46.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.95 155.57 23.95 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.59 -0.694 . . . . 0.0 109.619 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -79.62 -17.82 52.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.107 -0.995 . . . . 0.0 109.841 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 60.4 tttt -73.51 -33.47 64.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.003 . . . . 0.0 109.832 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.588 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 0.3 OUTLIER -86.34 5.02 36.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.062 -1.024 . . . . 0.0 109.853 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.471 HD22 ' CE1' ' A' ' 48' ' ' PHE . 4.0 tt -104.26 0.45 29.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.166 -0.959 . . . . 0.0 109.188 179.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -49.5 139.36 12.22 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.428 -0.795 . . . . 0.0 109.798 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.542 ' H ' ' CD ' ' A' ' 122' ' ' GLU . 0.1 OUTLIER -52.08 -53.81 37.89 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 109.878 -179.871 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ASP . . . . . 0.401 ' OD1' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.01 -48.81 72.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.096 -1.002 . . . . 0.0 109.825 -179.265 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 65.9 t80 -48.48 -42.69 33.53 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 122.203 1.001 . . . . 0.0 109.073 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -76.11 -24.28 16.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.908 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.7 ttp180 -65.1 -55.71 17.18 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.238 -0.914 . . . . 0.0 109.107 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.0 t -62.52 -21.4 65.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -76.55 -41.74 45.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.436 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.3 mt -69.14 -38.7 78.96 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.154 -0.966 . . . . 0.0 108.56 179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? . . . . . 0 C--N 1.305 -1.362 0 O-C-N 121.153 -0.967 . . . . 0.0 108.567 178.891 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.451 ' CB ' HG23 ' A' ' 35' ' ' THR . 3.7 mtpt -130.18 135.95 48.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.394 -0.816 . . . . 0.0 109.48 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.522 ' HB ' HD13 ' A' ' 100' ' ' LEU . 3.9 tp -118.46 130.28 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.47 -0.769 . . . . 0.0 109.335 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.504 ' O ' ' N ' ' A' ' 8' ' ' GLU . 5.6 m-20 -91.73 39.68 1.02 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.118 -0.989 . . . . 0.0 109.051 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.694 ' NZ ' ' H ' ' A' ' 104' ' ' VAL . 3.5 mttt -42.43 -23.34 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.813 -179.509 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.52 ' H ' ' CD ' ' A' ' 8' ' ' GLU . 39.3 mp0 -50.11 -35.46 25.69 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.093 -1.005 . . . . 0.0 108.364 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.42 -46.02 13.01 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.57 ' O ' ' N ' ' A' ' 14' ' ' TYR . 13.0 t -60.67 -66.17 0.57 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.242 -0.911 . . . . 0.0 109.489 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.484 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 32.0 ttp180 -44.19 -56.24 4.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.756 -1.215 . . . . 0.0 109.882 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.13 -28.07 67.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.01 -1.056 . . . . 0.0 109.762 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.458 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -88.5 -58.22 2.63 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.073 -1.017 . . . . 0.0 109.605 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.661 ' CD1' ' CD1' ' A' ' 61' ' ' PHE . 5.9 t80 -45.16 -51.18 10.76 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.301 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.536 ' N ' ' ND2' ' A' ' 15' ' ' ASN . 0.3 OUTLIER -71.22 -45.04 64.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.023 -1.048 . . . . 0.0 110.248 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.522 ' C ' ' H ' ' A' ' 18' ' ' ARG . 20.6 tp -41.54 -48.64 3.98 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.076 -1.015 . . . . 0.0 110.063 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 14' ' ' TYR . 1.2 m -53.85 -4.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.062 -1.024 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.522 ' H ' ' C ' ' A' ' 16' ' ' LEU . 6.8 ttm180 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.149 -0.97 . . . . 0.0 109.285 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.721 ' O ' HG22 ' A' ' 24' ' ' VAL . 4.6 p 35.39 57.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.676 -0.64 . . . . 0.0 110.458 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.813 HG22 ' O ' ' A' ' 42' ' ' GLY . 6.9 tt -42.92 -41.63 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.173 -0.954 . . . . 0.0 109.267 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.663 ' CD1' HG23 ' A' ' 25' ' ' ILE . 43.2 p-90 -149.25 166.78 27.89 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 120.992 -1.067 . . . . 0.0 110.261 178.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.453 HG13 ' CG2' ' A' ' 24' ' ' VAL . 18.3 m -137.68 141.81 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.891 . . . . 0.0 109.329 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.596 HG23 ' CE3' ' A' ' 26' ' ' TRP . 66.5 p -129.17 140.19 51.61 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 109.877 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.99 125.27 44.93 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -100.08 148.39 24.61 Favored 'General case' 0 C--N 1.296 -1.722 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.334 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.925 ' OH ' HG23 ' A' ' 94' ' ' THR . 23.0 m-85 -57.87 98.7 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.558 -0.714 . . . . 0.0 109.779 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.61 102.07 13.47 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.114 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.28 -126.14 9.18 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.95 17.9 21.26 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.41 -1.053 . . . . 0.0 110.041 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.451 HG23 ' CB ' ' A' ' 4' ' ' LYS . 1.8 m -138.23 136.4 36.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.244 -0.91 . . . . 0.0 110.042 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.521 ' CD1' ' OD1' ' A' ' 97' ' ' ASP . 4.3 mp -79.78 115.36 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.38 150.83 73.56 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 109.937 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -34.56 152.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.376 0 C-N-CA 122.89 2.393 . . . . 0.0 112.324 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.29 -53.25 0.07 OUTLIER Glycine 0 N--CA 1.489 2.207 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.639 ' OD2' ' NE2' ' A' ' 51' ' ' GLN . 14.1 t70 -143.28 179.53 7.03 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.713 -0.875 . . . . 0.0 108.976 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.589 ' H ' ' CD ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -140.98 -165.98 2.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 110.057 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.813 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.06 131.65 2.5 Favored Glycine 0 N--CA 1.486 1.969 0 N-CA-C 109.864 -1.295 . . . . 0.0 109.864 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.83 -5.06 21.51 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -148.3 164.84 32.81 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.465 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.56 ' C ' ' CD1' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -78.48 -11.4 59.95 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.033 -1.042 . . . . 0.0 109.585 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.54 -31.23 63.55 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.057 -1.027 . . . . 0.0 109.759 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.448 ' O ' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.47 -51.84 32.3 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.978 -1.076 . . . . 0.0 109.751 -179.666 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.687 ' CE1' HD22 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -43.25 -36.75 1.9 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.548 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.425 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mm -63.65 -41.31 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.339 -0.85 . . . . 0.0 110.455 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 50' ' ' GLN . 1.6 tm0? -87.06 -15.74 37.67 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.639 ' NE2' ' OD2' ' A' ' 40' ' ' ASP . 14.6 mm-40 -99.25 61.47 1.22 Allowed 'General case' 0 C--N 1.3 -1.579 0 CA-C-O 122.261 1.029 . . . . 0.0 109.925 -179.089 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 14.3 p -179.86 56.63 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.27 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.555 ' O ' ' NE1' ' A' ' 81' ' ' TRP . 3.1 p -77.87 156.01 30.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.058 -1.026 . . . . 0.0 110.025 -179.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.13 12.35 0.57 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.815 . . . . 0.0 109.847 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 53' ' ' THR . 20.9 m-20 -97.89 1.21 47.85 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.199 -0.938 . . . . 0.0 109.74 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.567 HG13 ' N ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.34 -179.65 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.043 -1.036 . . . . 0.0 110.293 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.802 ' CZ ' HG11 ' A' ' 86' ' ' VAL . 5.2 ptp180 -140.17 138.64 35.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.32 -0.862 . . . . 0.0 110.024 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.746 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.7 pp -172.22 169.09 5.54 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.418 -0.802 . . . . 0.0 109.409 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.529 ' O ' HG22 ' A' ' 28' ' ' THR . 3.8 m-85 -101.02 153.02 19.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.028 -1.045 . . . . 0.0 109.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.737 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -123.94 152.31 42.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.302 -0.874 . . . . 0.0 109.045 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.661 ' CD1' ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -140.47 96.34 3.02 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.413 -0.805 . . . . 0.0 109.087 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.5 ' O ' ' CE2' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -133.99 129.87 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 120.735 -1.228 . . . . 0.0 109.869 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.653 ' HE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ptm180 -68.16 142.86 55.6 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.175 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.5 ' CE2' ' O ' ' A' ' 62' ' ' VAL . 97.9 m-85 -118.79 155.92 30.3 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.796 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 m -81.75 131.43 35.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.157 -0.965 . . . . 0.0 109.037 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.353 -0.842 . . . . 0.0 109.484 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.653 ' CB ' ' HE ' ' A' ' 63' ' ' ARG . 21.0 p . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.189 0.519 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.688 ' NZ ' ' HB3' ' A' ' 109' ' ' ALA . 3.7 ttpt -104.59 170.2 8.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.443 -0.786 . . . . 0.0 109.08 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 109' ' ' ALA . 79.1 m-85 -134.06 126.78 30.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.126 -0.984 . . . . 0.0 111.289 -178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.508 ' HB2' ' NZ ' ' A' ' 75' ' ' LYS . . . -144.79 166.6 24.79 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.518 -0.739 . . . . 0.0 110.439 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.549 HD12 ' CE2' ' A' ' 61' ' ' PHE . 2.1 tt -113.85 151.43 32.14 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.737 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 7.6 mt -128.22 131.93 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 120.949 -1.094 . . . . 0.0 109.563 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.5 m -100.98 124.61 46.96 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.348 -0.845 . . . . 0.0 109.831 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.555 ' NE1' ' O ' ' A' ' 53' ' ' THR . 58.0 t-105 -102.45 111.96 24.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.175 -0.953 . . . . 0.0 109.831 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mm -109.86 93.35 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.26 153.95 48.03 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -104.63 56.26 0.71 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.63 -0.923 . . . . 0.0 109.612 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 86' ' ' VAL . 7.9 t70 -158.59 -39.02 0.06 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.217 -0.927 . . . . 0.0 109.528 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.802 HG11 ' CZ ' ' A' ' 57' ' ' ARG . 12.6 p -40.87 156.97 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.981 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.414 ' N ' HG22 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -66.95 -176.1 0.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.312 -0.868 . . . . 0.0 109.54 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.459 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.35 -22.76 53.46 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -46.68 -70.03 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.153 -1.204 . . . . 0.0 110.074 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.4 ' CB ' HH11 ' A' ' 57' ' ' ARG . 58.3 mt-30 -48.06 -21.71 0.5 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 109.82 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.459 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 5.7 ttt180 -58.66 -45.26 89.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.966 -1.084 . . . . 0.0 109.578 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.48 -37.4 56.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.247 -0.908 . . . . 0.0 109.793 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 94' ' ' THR . 4.4 mttm -73.71 -52.94 11.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.154 -0.966 . . . . 0.0 109.539 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.925 HG23 ' OH ' ' A' ' 31' ' ' TYR . 59.6 m -45.34 -56.02 5.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -44.38 -60.2 3.76 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -63.79 -50.73 67.83 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.974 -1.309 . . . . 0.0 110.223 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.521 ' OD1' ' CD1' ' A' ' 36' ' ' ILE . 3.4 t70 -57.14 -47.05 82.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.989 -1.069 . . . . 0.0 110.283 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 97' ' ' ASP . 6.1 ptmt -47.62 -33.32 6.52 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.839 -1.145 . . . . 0.0 107.984 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.7 m -59.87 -40.33 88.29 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.522 HD13 ' HB ' ' A' ' 5' ' ' ILE . 95.6 mt -49.75 -60.4 2.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.537 ' C ' ' H ' ' A' ' 103' ' ' GLU . 21.6 t -53.36 -46.62 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -65.44 7.85 0.19 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.537 ' H ' ' C ' ' A' ' 101' ' ' VAL . 19.8 tt0 -100.05 -44.58 5.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.427 -0.796 . . . . 0.0 110.325 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.784 ' O ' HG12 ' A' ' 104' ' ' VAL . 77.2 t -126.01 60.05 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.233 -0.917 . . . . 0.0 110.839 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.578 ' O ' HG12 ' A' ' 105' ' ' VAL . 4.2 t -130.52 96.94 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.075 -1.016 . . . . 0.0 109.56 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.585 ' C ' ' H ' ' A' ' 108' ' ' PHE . 35.0 mt-30 -120.2 -35.67 3.4 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.444 ' CG ' ' O ' ' A' ' 107' ' ' ASN . 36.6 t30 -62.53 35.45 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.7 -0.625 . . . . 0.0 110.298 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.585 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -139.14 150.69 45.93 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.164 -0.96 . . . . 0.0 108.983 178.993 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.688 ' HB3' ' NZ ' ' A' ' 75' ' ' LYS . . . -79.48 -44.27 21.6 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.331 -0.856 . . . . 0.0 109.502 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -160.87 159.51 29.87 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.143 -0.973 . . . . 0.0 109.481 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.62 157.41 17.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.25 -0.906 . . . . 0.0 109.164 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -117.75 142.35 47.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.643 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.8 t -110.6 97.03 5.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.448 HG22 ' H ' ' A' ' 116' ' ' ASP . 10.3 mm -103.47 152.32 6.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 O-C-N 121.3 -0.875 . . . . 0.0 110.828 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.5 p -139.77 5.37 2.17 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.448 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -160.46 155.39 24.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.386 -0.821 . . . . 0.0 109.271 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 20.7 mtm180 -67.08 -24.12 65.93 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 0.0 109.769 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -69.33 -23.03 63.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.0 109.216 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.421 ' CB ' HG23 ' A' ' 114' ' ' ILE . 30.0 mt-10 -86.56 -1.89 58.02 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.389 -0.819 . . . . 0.0 109.648 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.687 HD22 ' CE1' ' A' ' 48' ' ' PHE . 2.9 mt -107.08 25.54 11.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.257 -0.902 . . . . 0.0 109.429 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -82.98 146.32 28.85 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.403 -0.811 . . . . 0.0 109.646 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 1.001 ' HB2' ' NH2' ' A' ' 126' ' ' ARG . 0.2 OUTLIER -52.56 -55.32 23.04 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.132 -0.98 . . . . 0.0 109.338 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.11 -19.66 14.14 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.306 -0.872 . . . . 0.0 110.232 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.501 ' C ' ' CD1' ' A' ' 124' ' ' PHE . 16.5 t80 -86.86 -49.14 7.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.215 -0.928 . . . . 0.0 109.074 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.3 mm -75.96 -25.7 17.2 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.788 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 1.001 ' NH2' ' HB2' ' A' ' 122' ' ' GLU . 1.8 ttm-85 -73.04 -54.64 8.05 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.159 -0.963 . . . . 0.0 109.007 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.8 t -63.81 -12.39 35.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.412 -0.805 . . . . 0.0 109.578 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -84.82 -38.11 19.93 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.19 -0.944 . . . . 0.0 109.601 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.615 HD22 ' NZ ' ' A' ' 75' ' ' LYS . 92.2 mt -72.57 -39.99 66.98 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.946 . . . . 0.0 109.315 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LYS . . . . . 0.991 ' HZ2' ' HA ' ' A' ' 130' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.094 -1.004 . . . . 0.0 109.512 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' THR . . . . . 0.617 HG21 ' OD1' ' A' ' 97' ' ' ASP . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -134.06 118.27 17.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.385 -0.822 . . . . 0.0 109.176 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.89 140.41 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.869 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 2.6 t70 -97.07 45.48 1.04 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 108.959 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.446 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -40.46 -21.58 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.432 -0.793 . . . . 0.0 109.724 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.7 tt0 -52.88 -42.17 65.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.241 -0.912 . . . . 0.0 109.28 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.57 -67.04 0.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.192 -0.942 . . . . 0.0 109.419 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.646 ' SG ' ' CE2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -44.69 -60.59 1.93 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.206 -0.934 . . . . 0.0 109.701 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.534 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 11.3 ttp180 -44.22 -58.54 2.82 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.927 -1.108 . . . . 0.0 109.778 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.68 -28.94 16.27 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.062 -1.024 . . . . 0.0 109.229 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.946 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -87.69 -50.92 6.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.198 -0.938 . . . . 0.0 109.776 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.481 ' OH ' HD12 ' A' ' 78' ' ' LEU . 6.1 m-85 -45.74 -56.17 5.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.941 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.534 ' ND2' ' O ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -64.25 -40.1 95.31 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.11 -0.994 . . . . 0.0 109.411 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.6 -25.5 66.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.884 . . . . 0.0 109.275 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.946 HG23 ' O ' ' A' ' 13' ' ' ALA . 29.6 t -80.88 -13.9 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.245 -0.909 . . . . 0.0 109.377 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.241 179.878 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.21 0.528 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.793 HG23 ' O ' ' A' ' 24' ' ' VAL . 12.4 m -59.35 70.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.31 -0.869 . . . . 0.0 110.449 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.806 HG23 ' CD1' ' A' ' 26' ' ' TRP . 2.2 tt -45.69 -41.73 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.923 -1.11 . . . . 0.0 108.366 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.806 ' CD1' HG23 ' A' ' 25' ' ' ILE . 33.2 p-90 -142.95 136.97 29.07 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.714 -1.241 . . . . 0.0 109.776 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -115.24 144.87 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.42 -0.8 . . . . 0.0 110.107 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.598 ' HB ' HD13 ' A' ' 58' ' ' LEU . 6.4 p -133.71 144.02 48.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.429 -0.795 . . . . 0.0 110.972 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.646 ' CE2' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -129.42 130.05 45.47 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 179.297 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -107.7 149.43 28.15 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.465 -0.772 . . . . 0.0 109.597 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.405 ' OH ' HG23 ' A' ' 94' ' ' THR . 6.0 m-85 -49.02 98.73 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.455 -0.778 . . . . 0.0 109.912 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.64 101.61 13.48 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.94 -119.07 16.59 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.08 22.83 15.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.394 -1.062 . . . . 0.0 110.015 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 m -145.7 129.35 17.1 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.19 -0.944 . . . . 0.0 109.765 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.747 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.6 mp -78.54 113.84 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 108.947 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.424 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -135.58 153.7 77.77 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.285 -0.884 . . . . 0.0 109.822 -179.304 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.424 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.9 Cg_exo -32.02 145.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.357 0 C-N-CA 122.989 2.46 . . . . 0.0 112.26 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -139.1 -33.38 0.17 Allowed Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.542 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -143.28 -179.0 6.13 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 121.715 -0.873 . . . . 0.0 109.276 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.506 HE22 ' CD2' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -153.17 -171.53 3.95 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.797 0.808 . . . . 0.0 110.838 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.68 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -166.71 128.2 1.71 Allowed Glycine 0 N--CA 1.483 1.822 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.08 -10.04 17.43 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -155.35 172.05 18.85 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.467 ' OH ' ' O ' ' A' ' 120' ' ' LEU . 9.4 t80 -70.22 -45.83 65.75 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 120.895 -1.128 . . . . 0.0 109.332 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.458 ' N ' ' CD ' ' A' ' 46' ' ' GLN . 2.5 mp0 -46.94 -39.19 11.84 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.083 -1.011 . . . . 0.0 110.087 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.506 ' CD2' HE22 ' A' ' 41' ' ' GLN . 2.9 t60 -53.18 -24.65 11.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.576 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -72.3 -25.77 61.71 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.175 -0.953 . . . . 0.0 109.074 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.447 HG12 ' CE2' ' A' ' 48' ' ' PHE . 7.4 mt -83.35 -15.81 11.41 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 O-C-N 121.104 -0.998 . . . . 0.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -88.3 -53.18 4.82 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.986 -1.071 . . . . 0.0 110.665 -179.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.562 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -102.79 55.87 0.77 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.509 -0.745 . . . . 0.0 111.681 -177.427 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.576 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 34.4 m -155.38 63.64 0.62 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.93 -1.106 . . . . 0.0 109.792 179.046 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.596 ' C ' ' H ' ' A' ' 55' ' ' ASP . 10.2 p -87.75 158.67 18.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.146 -0.971 . . . . 0.0 110.029 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -60.23 12.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.333 -0.854 . . . . 0.0 110.56 -179.69 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.596 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -111.23 27.79 9.35 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 109.878 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.536 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.0 OUTLIER -148.21 148.76 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.087 -1.008 . . . . 0.0 109.816 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.561 ' H ' ' CD ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -125.99 128.75 47.96 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.459 -0.776 . . . . 0.0 109.625 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.598 HD13 ' HB ' ' A' ' 28' ' ' THR . 2.7 pp -172.64 -173.38 1.0 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.046 -1.034 . . . . 0.0 109.985 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.564 ' N ' ' CD1' ' A' ' 59' ' ' PHE . 3.4 m-85 -114.68 159.18 20.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.354 -0.842 . . . . 0.0 108.812 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 79' ' ' ILE . . . -139.34 150.99 46.01 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.789 -1.194 . . . . 0.0 109.143 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.516 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 28.1 t80 -148.86 97.11 2.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.175 -0.953 . . . . 0.0 109.181 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -117.07 152.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.071 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.9 119.07 22.26 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.491 -0.756 . . . . 0.0 109.163 179.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -100.47 156.22 17.39 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 0.0 109.573 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.0 t -77.73 141.64 39.19 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.17 -0.956 . . . . 0.0 108.975 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.472 -0.767 . . . . 0.0 109.42 -179.905 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.8 mmtt -104.63 158.09 16.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 109.813 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.49 ' O ' ' N ' ' A' ' 109' ' ' ALA . 65.7 m-85 -133.5 118.99 18.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.486 -0.759 . . . . 0.0 109.459 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.28 160.33 41.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.407 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.481 HD12 ' OH ' ' A' ' 14' ' ' TYR . 5.3 tt -105.99 157.13 17.73 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.593 HG21 HD11 ' A' ' 120' ' ' LEU . 2.8 mt -135.13 136.1 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.072 -1.017 . . . . 0.0 108.961 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -95.96 117.16 30.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.584 ' N ' ' O ' ' A' ' 58' ' ' LEU . 66.8 t-105 -95.22 111.25 23.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.869 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.415 ' O ' ' C ' ' A' ' 83' ' ' GLY . 4.4 mm -116.41 92.77 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.66 161.77 0.06 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -88.85 -27.49 21.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.344 -1.092 . . . . 0.0 109.565 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.9 47.59 0.87 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.323 -0.86 . . . . 0.0 109.664 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.23 166.26 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.286 -0.884 . . . . 0.0 109.733 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.533 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 11.2 t -87.11 -170.92 3.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.398 -0.814 . . . . 0.0 109.748 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.533 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.2 -16.64 66.56 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -45.93 -41.37 11.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.134 -1.215 . . . . 0.0 109.822 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.651 ' H ' ' CD ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -68.76 -29.38 67.76 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.113 -0.992 . . . . 0.0 109.076 179.641 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.439 ' N ' ' O ' ' A' ' 88' ' ' GLY . 10.0 tmm_? -53.59 -60.78 2.87 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 110.206 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.62 -42.63 34.27 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.11 -0.994 . . . . 0.0 110.131 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -61.96 -63.65 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.102 -0.999 . . . . 0.0 110.049 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.405 HG23 ' OH ' ' A' ' 31' ' ' TYR . 13.6 m -45.33 -51.56 10.92 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.152 -0.967 . . . . 0.0 109.806 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -43.19 -65.46 1.45 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -49.48 72.93 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.106 -1.232 . . . . 0.0 111.34 -178.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.617 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.1 OUTLIER -68.23 -39.75 82.22 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.87 -1.144 . . . . 0.0 111.593 -177.589 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -23.95 64.67 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 120.732 -1.23 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.0 m -83.32 -20.52 34.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 108.694 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -79.56 -61.22 2.07 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.433 -0.792 . . . . 0.0 109.366 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.1 p -56.46 -28.37 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.244 -0.91 . . . . 0.0 109.971 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.864 ' O ' HG12 ' A' ' 105' ' ' VAL . 16.4 tttt -71.55 -39.56 70.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.127 -0.983 . . . . 0.0 109.708 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.62 -31.4 69.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.111 -0.993 . . . . 0.0 110.097 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.6 t -97.14 36.92 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 102' ' ' LYS . 8.4 p -119.53 66.02 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.272 -0.892 . . . . 0.0 109.404 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.15 42.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.204 -0.935 . . . . 0.0 109.802 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -136.33 -31.04 0.9 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.553 ' C ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -72.78 -164.65 0.17 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.323 -0.861 . . . . 0.0 110.104 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -132.6 -27.58 1.71 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.504 -0.747 . . . . 0.0 109.091 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 21.3 tttp -162.2 150.63 14.87 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.304 -0.873 . . . . 0.0 109.404 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.81 149.23 25.83 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.241 -0.912 . . . . 0.0 109.278 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -135.74 153.98 51.39 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.343 -0.848 . . . . 0.0 109.966 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 5.8 p -120.9 137.7 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.65 HG22 ' H ' ' A' ' 116' ' ' ASP . 4.4 mm -127.07 160.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.858 . . . . 0.0 110.433 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.518 ' N ' HG22 ' A' ' 114' ' ' ILE . 14.3 t -140.63 5.64 2.01 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.65 ' H ' HG22 ' A' ' 114' ' ' ILE . 49.6 m-20 -146.06 155.3 42.69 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.37 -0.831 . . . . 0.0 109.392 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -75.99 -30.93 58.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.241 -0.912 . . . . 0.0 110.045 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -76.17 -7.73 55.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.145 -0.972 . . . . 0.0 109.368 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.907 ' OE1' ' CE1' ' A' ' 124' ' ' PHE . 2.4 mm-40 -86.58 3.87 42.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.205 -0.934 . . . . 0.0 109.785 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.593 HD11 HG21 ' A' ' 79' ' ' ILE . 1.6 tp -98.91 -0.35 42.46 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.236 -0.915 . . . . 0.0 108.993 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.19 144.41 12.55 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.578 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 122' ' ' GLU . 1.0 OUTLIER -61.36 -48.58 80.62 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.244 -0.91 . . . . 0.0 109.78 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -56.23 -20.42 18.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.921 . . . . 0.0 109.679 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.907 ' CE1' ' OE1' ' A' ' 119' ' ' GLU . 78.3 t80 -86.67 -50.69 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.169 -0.957 . . . . 0.0 109.269 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -73.7 -25.62 20.89 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -69.47 -51.83 32.35 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.174 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.3 t -63.81 -17.95 63.62 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.275 -0.89 . . . . 0.0 109.325 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -73.06 -42.11 63.43 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.238 -0.914 . . . . 0.0 109.265 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 34.9 mt -73.19 -51.13 18.94 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.276 -0.89 . . . . 0.0 109.099 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? . . . . . 0 N--CA 1.488 1.449 0 O-C-N 121.139 -0.976 . . . . 0.0 109.586 179.966 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 35' ' ' THR . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.724 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.621 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.423 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.587 ' O ' ' NE ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.804 ' O ' HG22 ' A' ' 24' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.709 HG22 ' O ' ' A' ' 42' ' ' GLY . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.688 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.621 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.771 ' OH ' HG23 ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.447 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.709 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.614 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.446 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.591 ' O ' HG23 ' A' ' 53' ' ' THR . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.2 mm-40 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.463 ' SG ' HD21 ' A' ' 120' ' ' LEU . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.521 ' HD2' ' H ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.553 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.825 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.633 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.825 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.714 ' HD3' HD13 ' A' ' 129' ' ' LEU . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.454 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.62 ' CG2' HD12 ' A' ' 114' ' ' ILE . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.441 HG23 ' CD2' ' A' ' 59' ' ' PHE . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 80' ' ' THR . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.525 ' N ' ' CD ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' THR . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.771 HG23 ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' ALA . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.415 ' OD2' HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 104' ' ' VAL . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.427 ' O ' HG12 ' A' ' 105' ' ' VAL . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.558 ' O ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.62 HD12 ' CG2' ' A' ' 79' ' ' ILE . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.661 ' H ' ' CD ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.714 HD13 ' HD3' ' A' ' 75' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -140.95 118.24 11.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.302 -0.874 . . . . 0.0 109.344 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 1.614 HD11 ' CG1' ' A' ' 101' ' ' VAL . 15.0 tt -107.53 146.39 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.626 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.8 p30 -75.72 -51.99 11.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.083 -1.01 . . . . 0.0 110.829 -178.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.8 ' CD ' HG21 ' A' ' 104' ' ' VAL . 5.7 mttm 64.29 -43.06 0.28 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.296 -0.877 . . . . 0.0 109.797 -179.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.8 tm-20 -46.36 -38.83 9.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 109.843 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.9 -60.03 2.47 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.188 -0.945 . . . . 0.0 109.487 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -44.91 -69.65 0.13 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.377 -0.827 . . . . 0.0 110.159 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -45.45 -56.18 5.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.63 -43.96 69.14 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.189 -0.945 . . . . 0.0 110.253 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.657 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -78.01 -45.61 23.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.007 -1.058 . . . . 0.0 110.369 -179.123 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 3.0 m-30 -45.43 -55.2 6.37 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 110.249 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.53 ' ND2' ' OD1' ' A' ' 107' ' ' ASN . 0.3 OUTLIER -71.23 -21.64 62.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.062 -1.024 . . . . 0.0 109.803 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.7 tp -72.18 -41.2 67.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.215 -0.928 . . . . 0.0 109.872 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.657 HG13 ' O ' ' A' ' 13' ' ' ALA . 0.9 OUTLIER -69.82 -10.22 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 109.462 -179.754 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.491 ' NH2' ' OD1' ' A' ' 15' ' ' ASN . 10.0 ttm180 . . . . . 0 N--CA 1.489 1.51 0 O-C-N 121.239 -0.913 . . . . 0.0 109.306 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.411 0.624 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.541 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.5 OUTLIER -70.06 128.66 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.415 -0.803 . . . . 0.0 109.907 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.823 HG23 ' CD1' ' A' ' 26' ' ' TRP . 12.3 tt -61.89 -34.26 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.108 -0.995 . . . . 0.0 108.757 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.823 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.1 p-90 -160.29 151.96 19.86 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.268 -0.895 . . . . 0.0 109.386 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.6 m -119.22 141.67 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.442 -0.786 . . . . 0.0 109.355 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.586 ' HB ' HD13 ' A' ' 58' ' ' LEU . 41.3 p -131.99 136.31 47.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.863 . . . . 0.0 109.547 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.496 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.36 163.86 15.72 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.452 ' O ' ' C ' ' A' ' 31' ' ' TYR . 10.6 ptm180 -140.81 147.76 39.54 Favored 'General case' 0 C--N 1.289 -2.029 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.443 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.661 ' OH ' ' OD1' ' A' ' 97' ' ' ASP . 3.9 m-85 -39.85 98.68 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.73 -0.607 . . . . 0.0 110.241 -178.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 1.184 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -96.86 101.42 13.0 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.554 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 51.5 -119.89 9.09 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 108.683 -1.767 . . . . 0.0 108.683 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.96 21.58 17.33 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.364 -1.08 . . . . 0.0 110.095 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' THR . . . . . 1.184 ' O ' ' OD1' ' A' ' 32' ' ' ASP . 1.4 m -142.3 133.1 25.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 109.781 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.478 HD11 ' CE1' ' A' ' 31' ' ' TYR . 1.6 mp -80.64 110.56 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.349 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.932 HG13 ' OD1' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -135.5 153.49 77.76 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.358 -0.839 . . . . 0.0 109.63 -179.698 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 37' ' ' VAL . 86.4 Cg_exo -33.84 146.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.993 2.462 . . . . 0.0 112.316 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.2 -26.36 0.15 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.545 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -142.89 -178.56 5.87 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.421 -1.046 . . . . 0.0 109.466 -179.475 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.604 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -160.44 177.64 10.36 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 121.746 0.784 . . . . 0.0 110.736 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.758 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -163.69 135.82 3.97 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -108.03 -5.44 17.06 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -159.02 175.4 13.58 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -11.24 60.0 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.17 -0.956 . . . . 0.0 109.527 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -78.14 -31.77 49.98 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.936 -1.103 . . . . 0.0 110.149 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.59 -42.9 91.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.002 -1.061 . . . . 0.0 109.549 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.587 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -55.83 -31.22 62.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.342 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.45 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.3 mt -83.2 -13.96 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.016 -1.052 . . . . 0.0 109.999 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.18 -52.53 5.36 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.612 -1.305 . . . . 0.0 109.77 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.545 ' NE2' ' CG ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -100.74 55.05 0.86 Allowed 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 110.896 -178.413 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.9 t -154.0 67.14 0.73 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.003 -1.06 . . . . 0.0 109.64 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.59 ' C ' ' H ' ' A' ' 55' ' ' ASP . 7.6 p -84.44 154.9 22.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.248 -0.907 . . . . 0.0 110.003 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER -58.05 8.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.478 -0.763 . . . . 0.0 110.482 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.59 ' H ' ' C ' ' A' ' 53' ' ' THR . 2.5 m-20 -109.95 26.78 10.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 0.0 109.366 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.555 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.8 OUTLIER -147.27 148.0 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 109.63 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.581 ' NH2' ' O ' ' A' ' 83' ' ' GLY . 3.2 ptp180 -130.47 133.61 46.43 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 110.329 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.775 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.0 pp -172.63 179.51 2.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.698 . . . . 0.0 109.279 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.513 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.77 154.24 27.71 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.044 -1.035 . . . . 0.0 109.162 179.814 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.423 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -139.39 159.14 42.85 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.015 -1.053 . . . . 0.0 109.294 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 15.0 t80 -148.5 107.56 3.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.641 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -121.48 153.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.339 -0.85 . . . . 0.0 109.641 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -87.08 108.39 18.86 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -90.2 155.5 18.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.278 -0.888 . . . . 0.0 109.927 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.417 ' H ' HG22 ' A' ' 65' ' ' THR . 1.0 OUTLIER -80.74 140.04 35.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 108.809 179.339 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.141 -0.974 . . . . 0.0 109.547 -179.891 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.659 ' HG2' HD22 ' A' ' 129' ' ' LEU . 14.5 tptm -105.22 153.84 21.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 109.751 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.471 ' O ' ' N ' ' A' ' 109' ' ' ALA . 78.6 m-85 -126.88 120.47 29.3 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.492 -0.755 . . . . 0.0 109.371 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.18 160.4 41.5 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.003 . . . . 0.0 110.496 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.8 tt -108.78 158.0 18.05 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.4 mt -138.31 143.64 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 120.931 -1.105 . . . . 0.0 108.928 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.22 120.26 41.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.193 -0.942 . . . . 0.0 109.696 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' TRP . . . . . 0.555 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 61.1 t-105 -93.15 112.02 23.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.136 -0.977 . . . . 0.0 109.611 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.1 93.24 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 108.807 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.581 ' O ' ' NH2' ' A' ' 57' ' ' ARG . . . -64.67 160.4 41.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 54' ' ' ASP . 2.4 mm-40 -121.13 71.43 0.95 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.617 -0.931 . . . . 0.0 109.766 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.513 ' O ' ' O ' ' A' ' 86' ' ' VAL . 0.4 OUTLIER -178.12 -24.93 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.05 -1.031 . . . . 0.0 110.067 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.513 ' O ' ' O ' ' A' ' 85' ' ' ASP . 1.9 t -59.51 -134.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.064 -1.022 . . . . 0.0 109.787 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.7 m -125.93 -177.73 4.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.507 -0.746 . . . . 0.0 110.121 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.15 -18.04 63.65 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.903 -1.279 . . . . 0.0 109.903 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mp -47.69 -57.05 6.01 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.186 -1.184 . . . . 0.0 109.864 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.497 ' O ' ' N ' ' A' ' 94' ' ' THR . 1.0 OUTLIER -62.37 -31.38 72.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.192 -0.942 . . . . 0.0 109.729 -179.708 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 4.5 tpt180 -45.09 -65.79 0.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.753 -1.217 . . . . 0.0 110.042 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.61 -33.4 66.66 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.146 -0.971 . . . . 0.0 110.235 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.527 ' HG3' ' HH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -69.47 -58.66 3.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.132 -0.98 . . . . 0.0 109.87 -179.59 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.497 ' N ' ' O ' ' A' ' 90' ' ' GLN . 3.5 m -44.64 -36.4 3.07 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.144 -0.972 . . . . 0.0 109.362 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -57.53 -57.1 21.55 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 m -66.45 -47.28 73.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.956 -1.32 . . . . 0.0 111.143 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.661 ' OD1' ' OH ' ' A' ' 31' ' ' TYR . 3.0 m-20 -69.17 -43.27 74.58 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.745 -1.222 . . . . 0.0 111.434 -177.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.88 -26.11 33.48 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.68 -1.262 . . . . 0.0 108.702 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.5 m -75.66 -29.85 59.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.318 -0.864 . . . . 0.0 108.917 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.7 -58.47 5.03 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 1.614 ' CG1' HD11 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -65.85 -25.92 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.122 -0.986 . . . . 0.0 110.441 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.5 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.4 tttp -70.68 -37.99 73.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.06 -1.025 . . . . 0.0 109.945 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.456 ' C ' ' H ' ' A' ' 105' ' ' VAL . 27.6 tt0 -79.26 -37.35 38.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.528 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.8 HG21 ' CD ' ' A' ' 7' ' ' LYS . 2.9 p -73.19 18.56 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.016 -1.053 . . . . 0.0 110.029 -179.401 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 102' ' ' LYS . 4.5 p -98.31 133.5 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.107 -0.996 . . . . 0.0 109.635 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.973 ' C ' HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -138.8 31.15 2.26 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.382 -0.969 . . . . 0.0 108.382 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.973 HD21 ' C ' ' A' ' 106' ' ' GLN . 1.9 m120 -136.09 -22.95 1.35 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.611 -0.68 . . . . 0.0 110.118 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PHE . . . . . 0.572 ' C ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -81.92 168.35 18.0 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.957 -1.089 . . . . 0.0 110.281 -179.491 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -109.07 -29.33 8.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.566 -0.709 . . . . 0.0 109.166 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -162.28 151.74 15.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 109.404 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.97 154.28 20.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.324 -0.86 . . . . 0.0 109.244 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -136.46 159.13 42.71 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.268 -0.895 . . . . 0.0 109.9 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.6 p -121.67 144.23 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.561 HG22 ' H ' ' A' ' 116' ' ' ASP . 4.7 mm -129.13 158.51 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.166 -0.959 . . . . 0.0 110.172 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.484 ' N ' HG22 ' A' ' 114' ' ' ILE . 88.8 p -138.73 2.2 2.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.561 ' H ' HG22 ' A' ' 114' ' ' ILE . 4.1 m-20 -145.35 154.1 41.95 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.881 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.9 ttp180 -73.56 -31.36 63.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.215 -0.928 . . . . 0.0 109.856 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.78 -6.99 54.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.129 -0.982 . . . . 0.0 109.483 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.599 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 4.4 mm-40 -86.45 3.54 43.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.103 -0.998 . . . . 0.0 109.778 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.442 HD13 ' CE1' ' A' ' 48' ' ' PHE . 2.4 mt -105.97 13.95 28.61 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 109.001 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -64.62 148.54 50.68 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.514 -0.741 . . . . 0.0 109.793 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.25 -51.78 68.49 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.187 -0.946 . . . . 0.0 109.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -55.25 -21.92 16.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 109.738 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 66.3 t80 -84.83 -49.07 8.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.88 . . . . 0.0 109.143 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -69.32 -12.45 16.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -82.37 -50.31 9.05 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.145 -0.972 . . . . 0.0 109.644 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -24.13 67.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.221 -0.925 . . . . 0.0 110.458 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 129' ' ' LEU . 15.3 pt-20 -85.3 -39.77 17.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.96 -1.088 . . . . 0.0 109.713 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.659 HD22 ' HG2' ' A' ' 75' ' ' LYS . 5.4 mt -75.3 -36.26 61.17 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.121 -0.987 . . . . 0.0 108.664 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.491 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.556 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 41.1 mtt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.329 0.585 . . . . 0.0 109.505 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 67.16 -68.25 0.15 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.207 -0.933 . . . . 0.0 109.51 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.556 HG21 ' OD1' ' A' ' 97' ' ' ASP . 19.7 m -158.96 146.06 17.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.919 . . . . 0.0 109.527 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.28 118.36 18.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.415 -0.803 . . . . 0.0 109.079 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -107.57 139.62 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.333 -0.854 . . . . 0.0 109.89 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.591 ' O ' ' N ' ' A' ' 8' ' ' GLU . 46.9 t0 -100.54 35.71 2.07 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.273 -0.892 . . . . 0.0 108.989 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.725 ' HD2' HG11 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -43.63 -16.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.933 . . . . 0.0 109.4 -179.62 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.591 ' N ' ' O ' ' A' ' 6' ' ' ASP . 5.3 tt0 -54.11 -40.54 67.39 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.168 -0.957 . . . . 0.0 108.823 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -68.22 -63.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.384 -0.822 . . . . 0.0 108.804 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.647 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.2 m -44.65 -53.28 7.38 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.294 -0.879 . . . . 0.0 109.009 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 10' ' ' CYS . 20.6 ttt180 -43.55 -59.73 2.05 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.099 -1.0 . . . . 0.0 109.456 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.42 -40.79 2.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.389 -0.819 . . . . 0.0 109.556 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.86 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -86.46 -35.9 19.38 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.088 -1.008 . . . . 0.0 110.018 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.576 ' CE1' ' CZ ' ' A' ' 61' ' ' PHE . 1.2 t80 -45.44 -67.95 0.24 Allowed 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.431 -0.793 . . . . 0.0 110.36 -179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.548 ' CG ' ' ND2' ' A' ' 107' ' ' ASN . 0.8 OUTLIER -75.69 -32.74 60.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.356 -0.84 . . . . 0.0 110.746 -178.72 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.741 HD21 ' OG ' ' A' ' 22' ' ' SER . 12.6 tp -69.13 -27.89 65.97 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.749 -1.22 . . . . 0.0 109.146 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.86 HG23 ' O ' ' A' ' 13' ' ' ALA . 22.5 t -58.66 -1.65 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.539 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.9 OUTLIER -110.35 1.14 18.27 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.264 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.57 159.84 16.99 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.293 -0.88 . . . . 0.0 109.412 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -92.52 22.29 4.75 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.202 -0.936 . . . . 0.0 108.864 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.44 ' O ' ' C ' ' A' ' 22' ' ' SER . . . -109.66 -84.63 1.57 Allowed Glycine 0 N--CA 1.489 2.173 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.741 ' OG ' HD21 ' A' ' 16' ' ' LEU . 0.9 OUTLIER -41.02 -53.89 2.89 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.054 -1.262 . . . . 0.0 110.534 -178.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.704 ' HB3' ' O ' ' A' ' 22' ' ' SER . . . 77.94 -15.37 0.76 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.239 -0.913 . . . . 0.0 109.799 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.651 ' O ' HG13 ' A' ' 24' ' ' VAL . 6.9 p -46.44 91.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.992 -1.067 . . . . 0.0 108.932 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.5 tt -43.98 -54.07 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 121.25 -0.906 . . . . 0.0 109.7 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.653 ' CZ3' HG23 ' A' ' 28' ' ' THR . 41.8 p-90 -143.99 166.71 24.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.505 -1.372 . . . . 0.0 111.498 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.582 HG21 ' HB3' ' A' ' 13' ' ' ALA . 4.1 m -136.34 138.84 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.602 -0.686 . . . . 0.0 109.4 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.653 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 46.8 p -125.87 141.14 52.13 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.308 -0.87 . . . . 0.0 110.173 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.647 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.21 160.89 25.6 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.662 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -137.87 146.69 43.69 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 121.243 -0.911 . . . . 0.0 109.59 -179.598 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.567 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 4.7 m-85 -59.75 98.5 0.05 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.462 -0.774 . . . . 0.0 110.019 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.574 ' OD1' ' N ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -94.97 102.16 13.97 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.375 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.97 -119.84 7.0 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.2 26.89 10.1 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.325 -1.103 . . . . 0.0 110.615 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.484 ' C ' HD12 ' A' ' 36' ' ' ILE . 8.3 m -145.57 151.17 37.7 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.854 -1.154 . . . . 0.0 110.686 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.656 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.8 mp -101.55 107.22 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.44 HG22 ' CG ' ' A' ' 32' ' ' ASP . 0.9 OUTLIER -135.7 151.81 74.95 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.292 -0.88 . . . . 0.0 110.018 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.2 Cg_exo -31.88 139.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 123.069 2.513 . . . . 0.0 112.391 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.12 -35.56 0.21 Allowed Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.615 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.7 m-20 -142.71 -179.02 6.07 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.806 -0.82 . . . . 0.0 108.878 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.631 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -159.25 -170.19 2.89 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.368 -0.832 . . . . 0.0 110.138 -179.778 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.592 ' HA2' ' CD2' ' A' ' 47' ' ' HIS . . . -168.18 140.62 6.31 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.42 -4.78 15.4 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.04 175.22 13.79 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.429 ' O ' ' C ' ' A' ' 46' ' ' GLN . 1.3 t80 -72.18 -46.29 56.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 120.996 -1.065 . . . . 0.0 109.355 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 45' ' ' TYR . 6.3 mm100 -42.22 -29.38 0.24 Allowed 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.294 -0.879 . . . . 0.0 110.077 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.592 ' CD2' ' HA2' ' A' ' 42' ' ' GLY . 1.2 t-80 -66.62 -47.91 71.14 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.073 -1.017 . . . . 0.0 109.135 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.579 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -42.97 -28.0 0.23 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.442 ' C ' ' H ' ' A' ' 51' ' ' GLN . 1.9 mt -75.39 -45.56 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.371 -0.83 . . . . 0.0 110.605 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.432 ' O ' ' OE1' ' A' ' 50' ' ' GLN . 1.1 tm0? -81.4 8.34 9.55 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.615 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -119.82 -22.3 6.86 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.257 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.518 ' O ' HG23 ' A' ' 53' ' ' THR . 0.1 OUTLIER -69.35 141.08 54.29 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.206 -0.934 . . . . 0.0 109.298 179.73 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 52' ' ' CYS . 33.0 p -157.43 114.19 2.97 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.594 -0.842 . . . . 0.0 110.741 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.569 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.5 OUTLIER -64.11 -0.53 1.21 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.434 ' H ' ' C ' ' A' ' 53' ' ' THR . 10.1 m-20 -110.12 19.12 19.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.448 -0.783 . . . . 0.0 109.373 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' OG1' ' A' ' 53' ' ' THR . 0.3 OUTLIER -144.13 166.18 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.0 110.158 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.718 HH12 ' N ' ' A' ' 91' ' ' ARG . 8.4 ptp180 -136.92 136.43 38.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.803 -0.759 . . . . 0.0 109.885 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.729 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.8 pp -172.31 166.59 5.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.395 -0.816 . . . . 0.0 109.692 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.516 ' O ' HG22 ' A' ' 28' ' ' THR . 31.4 m-85 -100.01 156.9 16.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.056 -1.028 . . . . 0.0 108.801 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.506 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -127.64 152.62 47.45 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.187 -0.946 . . . . 0.0 108.99 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.576 ' CZ ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -146.19 96.11 2.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.283 -0.886 . . . . 0.0 109.254 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -121.3 151.64 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.074 -1.016 . . . . 0.0 109.76 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.514 ' CZ ' ' OG ' ' A' ' 74' ' ' SER . 12.5 ttp180 -92.68 117.57 30.13 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -99.44 155.71 17.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.178 -0.951 . . . . 0.0 110.142 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 m -77.77 146.57 35.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.42 -0.8 . . . . 0.0 108.975 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.7 m -109.74 -27.34 9.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.49 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 49.44 46.39 36.59 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -171.94 -78.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.202 -1.175 . . . . 0.0 109.537 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.515 ' C ' ' H ' ' A' ' 71' ' ' SER . . . -56.58 100.55 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.189 -0.945 . . . . 0.0 109.468 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.0 ptt? -54.63 -5.02 0.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.273 -0.892 . . . . 0.0 109.504 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.531 ' C ' ' H ' ' A' ' 73' ' ' ARG . 37.1 m -60.08 103.42 0.22 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.287 -0.883 . . . . 0.0 109.511 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER 53.78 4.94 0.05 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.273 -0.892 . . . . 0.0 109.449 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.531 ' H ' ' C ' ' A' ' 71' ' ' SER . 17.9 mtp180 42.92 70.26 0.31 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.281 -0.887 . . . . 0.0 109.485 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 1.2 m 164.23 144.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.251 -0.906 . . . . 0.0 109.525 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tptp -105.3 161.84 13.94 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.353 -0.842 . . . . 0.0 109.711 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -133.09 124.46 27.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.429 -0.794 . . . . 0.0 109.449 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.92 159.39 43.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.839 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.71 ' O ' HD12 ' A' ' 79' ' ' ILE . 8.6 tp -111.25 150.04 30.16 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.71 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.5 mp -128.97 144.03 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.998 -1.064 . . . . 0.0 109.329 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.7 m -105.19 137.25 43.27 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.877 . . . . 0.0 109.944 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.2 t-105 -114.76 110.62 19.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.392 -0.817 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -105.95 93.49 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.16 -0.962 . . . . 0.0 109.119 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.93 155.73 29.84 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 54' ' ' ASP . 5.6 tp10 -105.92 42.9 1.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.458 -1.025 . . . . 0.0 109.521 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -161.84 19.17 0.11 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.167 -0.958 . . . . 0.0 109.613 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.567 HG21 ' HE ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -92.41 164.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.089 -1.007 . . . . 0.0 109.63 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -67.7 169.92 8.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.43 -0.794 . . . . 0.0 109.703 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.28 -16.65 66.35 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.3 mt -61.4 -70.24 0.2 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 110.347 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.437 ' HB2' HH11 ' A' ' 57' ' ' ARG . 1.4 mt-30 -52.4 -26.99 14.0 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.366 -0.834 . . . . 0.0 109.924 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.718 ' N ' HH12 ' A' ' 57' ' ' ARG . 0.5 OUTLIER -52.39 -59.5 4.35 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.046 . . . . 0.0 109.744 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.46 -23.31 66.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 109.823 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.437 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 4.0 tptp -74.91 -48.47 24.54 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.132 -0.98 . . . . 0.0 109.228 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.567 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 13.2 m -46.01 -45.93 16.18 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.218 -0.926 . . . . 0.0 109.27 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -54.53 -58.54 12.79 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.129 -1.188 . . . . 0.0 110.129 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 88.2 m -64.76 -47.31 78.64 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.037 -1.272 . . . . 0.0 111.132 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -71.95 -43.63 64.89 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.771 -1.205 . . . . 0.0 111.612 -177.574 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -54.58 -26.19 30.85 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.668 -1.27 . . . . 0.0 109.127 -179.433 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -27.36 41.54 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -0.879 . . . . 0.0 108.639 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 97' ' ' ASP . 1.9 mt -68.82 -59.22 3.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.508 -0.745 . . . . 0.0 109.607 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.0 p -62.46 -29.33 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.183 -0.948 . . . . 0.0 110.037 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -66.53 -38.16 86.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.152 -0.968 . . . . 0.0 109.663 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -67.42 -24.19 65.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.23 -0.919 . . . . 0.0 109.617 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.725 HG11 ' HD2' ' A' ' 7' ' ' LYS . 20.4 t -86.79 30.27 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.224 -0.922 . . . . 0.0 109.667 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.7 p -95.17 126.5 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.138 -0.977 . . . . 0.0 109.765 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.455 ' C ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -151.7 22.84 0.69 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.323 -0.861 . . . . 0.0 109.943 -179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.588 ' N ' ' OD1' ' A' ' 107' ' ' ASN . 0.1 OUTLIER -148.46 39.92 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.997 -1.064 . . . . 0.0 110.026 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.539 ' C ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -149.15 -165.71 2.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.925 -1.11 . . . . 0.0 110.596 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.426 ' N ' ' CG ' ' A' ' 108' ' ' PHE . . . -118.14 -50.55 2.46 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.747 -0.595 . . . . 0.0 109.773 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.579 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -158.7 157.1 31.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.101 -0.999 . . . . 0.0 109.952 -179.722 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.588 ' OE1' ' N ' ' A' ' 112' ' ' PHE . 0.0 OUTLIER -104.87 159.79 15.52 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.465 -0.772 . . . . 0.0 108.968 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.588 ' N ' ' OE1' ' A' ' 111' ' ' GLU . 23.6 m-85 -136.15 161.72 34.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.183 -0.948 . . . . 0.0 109.772 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 80.6 t -121.36 150.38 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.51 HG22 ' N ' ' A' ' 115' ' ' SER . 56.3 mt -138.65 161.06 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 110.182 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.51 ' N ' HG22 ' A' ' 114' ' ' ILE . 0.3 OUTLIER -141.18 6.3 1.94 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.347 -0.845 . . . . 0.0 109.311 179.449 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -150.95 155.41 39.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.035 -1.04 . . . . 0.0 109.924 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -70.53 -31.96 69.24 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.262 -0.899 . . . . 0.0 109.599 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -67.77 -16.67 64.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.152 -0.967 . . . . 0.0 108.99 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.594 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.0 OUTLIER -86.54 1.64 50.9 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.339 -0.851 . . . . 0.0 109.763 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.566 HD13 ' CD1' ' A' ' 48' ' ' PHE . 6.5 mt -97.49 20.17 12.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.199 -0.938 . . . . 0.0 108.87 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -74.84 152.72 38.92 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.552 -0.718 . . . . 0.0 109.883 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.98 -48.65 57.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 109.844 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -12.32 7.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.063 -1.023 . . . . 0.0 109.744 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.594 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 9.4 t80 -86.58 -49.07 7.81 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.938 0.875 . . . . 0.0 109.371 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 3.4 mt -74.8 -26.35 19.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.729 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.575 ' NE ' ' HZ1' ' A' ' 130' ' ' LYS . 29.9 ttt180 -68.59 -54.57 15.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.9 t -63.77 -15.8 59.57 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.345 -0.847 . . . . 0.0 109.663 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.545 ' CD ' ' CD1' ' A' ' 112' ' ' PHE . 2.2 tt0 -76.6 -39.99 50.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 109.246 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 12.8 mt -73.34 -48.06 37.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.229 -0.919 . . . . 0.0 109.244 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.575 ' HZ1' ' NE ' ' A' ' 126' ' ' ARG . 13.7 mttt -49.38 -24.15 1.8 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.116 -0.99 . . . . 0.0 109.376 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 132' ' ' ALA . 1.1 mtmm -72.1 -70.5 0.33 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.208 -0.932 . . . . 0.0 109.33 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 131' ' ' LYS . . . 42.48 62.72 1.62 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.262 -0.899 . . . . 0.0 109.49 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 134' ' ' GLY . . . -163.49 56.39 0.28 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 133' ' ' GLY . . . -43.02 123.07 3.75 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.458 ' C ' ' H ' ' A' ' 137' ' ' TYR . . . -137.08 10.86 3.06 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.333 -1.098 . . . . 0.0 109.487 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.24 0.56 0.42 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 109.392 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.458 ' H ' ' C ' ' A' ' 135' ' ' ALA . 1.8 t80 -48.35 -41.03 27.38 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.203 -0.936 . . . . 0.0 109.495 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.44 1.59 11.45 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.289 -0.882 . . . . 0.0 109.492 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -94.81 9.86 37.48 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.241 -0.912 . . . . 0.0 109.472 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 51.88 37.96 22.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.288 -0.883 . . . . 0.0 109.471 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.36 -177.71 0.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.235 -0.915 . . . . 0.0 109.465 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.02 -0.991 . . . . 0.0 109.468 -179.931 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.459 ' O ' ' O ' ' A' ' 2' ' ' ALA . 32.1 mtt . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 1' ' ' MET . . . 60.74 144.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 109.486 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.768 HG21 ' OD1' ' A' ' 97' ' ' ASP . 2.7 m -138.75 147.15 42.3 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.299 -0.875 . . . . 0.0 109.471 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.473 ' CB ' HG23 ' A' ' 35' ' ' THR . 59.7 mttt -135.26 118.32 16.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.353 -0.842 . . . . 0.0 109.403 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -107.76 141.23 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.398 -0.814 . . . . 0.0 109.733 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -100.69 70.11 1.41 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.528 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.769 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -58.98 -24.49 62.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.243 -0.911 . . . . 0.0 109.494 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -46.06 68.14 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.449 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -67.47 0.44 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.549 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.82 -63.0 1.01 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.935 . . . . 0.0 109.845 -179.665 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 10.5 ttp180 -44.59 -56.26 4.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.909 -1.12 . . . . 0.0 109.678 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.44 -54.8 27.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.188 -0.945 . . . . 0.0 109.908 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -66.65 -43.72 83.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.134 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.54 ' CZ ' ' CB ' ' A' ' 61' ' ' PHE . 3.2 m-85 -46.8 -55.24 8.24 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.336 -0.852 . . . . 0.0 110.312 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.94 -28.42 43.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.243 -0.911 . . . . 0.0 110.697 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.405 ' HA ' HD12 ' A' ' 16' ' ' LEU . 33.7 tp -56.49 -19.29 14.68 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.792 -1.192 . . . . 0.0 109.473 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 13' ' ' ALA . 1.5 m -77.58 -2.84 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.226 -0.921 . . . . 0.0 109.415 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.722 HH12 ' NH1' ' A' ' 73' ' ' ARG . 11.1 mtm180 -77.83 15.39 0.87 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -93.94 -156.97 0.52 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.89 . . . . 0.0 109.593 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -101.76 49.07 0.87 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.199 -0.938 . . . . 0.0 109.496 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.37 57.63 5.48 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -130.39 7.21 4.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.474 -1.015 . . . . 0.0 109.521 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.0 -162.12 1.15 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.39 -0.819 . . . . 0.0 109.919 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.733 HG21 ' CG1' ' A' ' 27' ' ' VAL . 13.9 m -78.4 122.88 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.437 -0.789 . . . . 0.0 109.649 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.859 HG23 ' CD1' ' A' ' 26' ' ' TRP . 14.0 tt -49.96 -34.27 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 120.894 -1.129 . . . . 0.0 108.4 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.859 ' CD1' HG23 ' A' ' 25' ' ' ILE . 37.0 p-90 -160.95 171.57 18.46 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.259 -0.9 . . . . 0.0 109.402 177.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.733 ' CG1' HG21 ' A' ' 24' ' ' VAL . 34.7 m -137.0 143.59 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.249 -0.907 . . . . 0.0 109.287 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.599 HG23 ' CE3' ' A' ' 26' ' ' TRP . 46.0 p -132.47 134.71 45.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.293 -0.879 . . . . 0.0 109.701 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.421 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -123.61 153.97 39.95 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.944 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.71 150.18 52.24 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.521 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.752 ' OH ' HG23 ' A' ' 94' ' ' THR . 1.8 m-85 -55.04 99.28 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.569 -0.707 . . . . 0.0 110.443 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.87 101.08 13.16 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 65.49 -117.32 9.89 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.8 25.64 11.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -1.112 . . . . 0.0 110.113 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -145.42 150.16 36.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.73 179.735 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mt -104.15 108.44 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.334 -0.854 . . . . 0.0 108.989 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.9 m -135.49 158.76 73.74 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.254 -0.904 . . . . 0.0 109.724 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 87.6 Cg_exo -30.08 142.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 123.493 2.795 . . . . 0.0 112.689 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -140.55 -30.67 0.17 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.462 ' OD1' ' OE1' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -142.5 -178.9 5.99 Favored 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.625 -0.926 . . . . 0.0 109.263 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.568 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -162.69 175.68 11.1 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.871 -178.678 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.773 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.14 137.26 4.65 Favored Glycine 0 N--CA 1.486 1.977 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.78 -3.42 20.45 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.0 177.54 10.25 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.37 -10.58 59.54 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 120.883 -1.135 . . . . 0.0 109.218 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -74.99 -36.68 61.99 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.049 -1.032 . . . . 0.0 110.255 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.546 ' O ' ' N ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -62.89 -53.3 56.32 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.966 -1.084 . . . . 0.0 109.569 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.572 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -45.45 -28.02 0.82 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.188 -0.945 . . . . 0.0 108.72 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.455 HG12 ' CE2' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -83.93 -17.01 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.272 -0.892 . . . . 0.0 110.134 179.405 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' A' ' 47' ' ' HIS . 5.3 tt0 -81.73 -54.45 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.775 -1.203 . . . . 0.0 109.176 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.462 ' OE1' ' OD1' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -72.47 -12.13 60.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.795 . . . . 0.0 109.736 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.411 ' C ' ' O ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -42.94 126.28 3.78 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.279 -0.888 . . . . 0.0 109.637 -179.625 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.521 ' C ' ' H ' ' A' ' 55' ' ' ASP . 5.6 p -150.62 110.49 4.08 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.873 0.844 . . . . 0.0 110.608 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -57.38 0.35 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.786 -0.571 . . . . 0.0 110.039 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.521 ' H ' ' C ' ' A' ' 53' ' ' THR . 50.7 t0 -109.05 31.86 5.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 109.56 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.37 168.31 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.022 -1.049 . . . . 0.0 110.477 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.644 HH12 ' N ' ' A' ' 91' ' ' ARG . 5.4 ptp180 -141.95 134.91 28.81 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.274 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.77 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.71 168.94 5.08 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.334 -0.854 . . . . 0.0 109.621 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.531 ' N ' ' CD1' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -108.71 160.56 15.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.128 -0.982 . . . . 0.0 109.003 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.47 157.37 45.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.93 -1.106 . . . . 0.0 109.365 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.54 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 37.1 t80 -148.48 104.2 3.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.278 -0.889 . . . . 0.0 109.221 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -120.07 153.38 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.356 -0.84 . . . . 0.0 109.447 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.495 ' NE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ttp180 -88.36 108.58 19.42 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.476 -0.765 . . . . 0.0 109.049 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -89.24 155.69 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.339 -0.85 . . . . 0.0 109.794 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 65' ' ' THR . 13.9 t -86.16 128.35 34.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.259 -0.901 . . . . 0.0 108.882 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -133.61 135.02 43.95 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.556 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.21 -40.62 1.5 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.517 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 0.3 OUTLIER 58.22 9.3 0.96 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.235 -1.156 . . . . 0.0 109.487 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.502 ' C ' ' H ' ' A' ' 71' ' ' SER . . . -102.73 150.32 23.58 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.296 -0.877 . . . . 0.0 109.482 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 7.4 mtt -71.66 36.35 0.06 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.182 -0.949 . . . . 0.0 109.496 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.502 ' H ' ' C ' ' A' ' 69' ' ' ALA . 69.8 m -101.17 -48.81 4.28 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.873 . . . . 0.0 109.428 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -100.79 -127.69 0.2 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 0.0 109.481 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.722 ' NH1' HH12 ' A' ' 18' ' ' ARG . 0.3 OUTLIER -173.58 69.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.495 ' CB ' ' NE ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER 56.93 160.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.304 -0.873 . . . . 0.0 109.391 -179.946 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.404 ' NZ ' ' HB1' ' A' ' 109' ' ' ALA . 29.7 tptt -104.83 154.81 19.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.564 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -127.58 122.28 32.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.434 -0.791 . . . . 0.0 109.651 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.496 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -144.62 167.27 22.94 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.64 -179.07 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.952 ' O ' HD12 ' A' ' 79' ' ' ILE . 5.5 tt -122.6 157.98 30.96 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.952 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.3 mp -136.09 149.62 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.96 -1.088 . . . . 0.0 108.626 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . 1.002 HG21 ' NZ ' ' A' ' 98' ' ' LYS . 55.7 m -112.66 120.09 40.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.515 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -95.18 111.87 23.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.124 -0.985 . . . . 0.0 109.853 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.0 mm -108.9 93.2 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 108.673 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.32 153.76 35.05 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -104.03 43.24 1.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.481 -1.011 . . . . 0.0 109.713 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.87 11.82 0.49 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.128 -0.982 . . . . 0.0 109.743 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 87' ' ' SER . 46.9 t -89.16 160.19 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.122 -0.986 . . . . 0.0 109.668 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 86' ' ' VAL . 0.4 OUTLIER -68.32 -176.96 0.81 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.433 -0.792 . . . . 0.0 109.796 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.21 -16.53 66.79 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.83 -70.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.167 -1.196 . . . . 0.0 110.239 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.605 ' CB ' HH11 ' A' ' 57' ' ' ARG . 76.9 mm-40 -60.04 -18.83 49.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.197 -0.94 . . . . 0.0 110.181 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.649 ' CG ' HH11 ' A' ' 91' ' ' ARG . 0.0 OUTLIER -55.25 -58.36 8.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.797 -1.189 . . . . 0.0 109.604 -179.875 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.89 -25.2 32.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.203 -0.936 . . . . 0.0 109.747 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.551 ' NZ ' ' OG1' ' A' ' 3' ' ' THR . 0.1 OUTLIER -72.11 -27.13 62.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 109.075 179.64 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.752 HG23 ' OH ' ' A' ' 31' ' ' TYR . 2.2 m -76.81 -52.1 10.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.396 -0.815 . . . . 0.0 109.106 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.451 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -41.77 -51.86 4.79 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.62 -56.53 9.04 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -1.15 . . . . 0.0 110.125 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.768 ' OD1' HG21 ' A' ' 3' ' ' THR . 84.4 m-20 -44.82 -37.95 4.19 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.13 -0.982 . . . . 0.0 110.52 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 1.002 ' NZ ' HG21 ' A' ' 80' ' ' THR . 0.2 OUTLIER -59.39 -43.36 92.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.775 -1.203 . . . . 0.0 108.193 179.357 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.4 m -46.83 -35.03 5.86 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.108 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.5 mt -71.18 -57.66 4.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.621 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 p -67.9 -13.68 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.169 -0.957 . . . . 0.0 110.052 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.403 ' O ' HG12 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -81.85 -42.51 19.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.0 110.363 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.66 -25.41 30.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.035 -1.041 . . . . 0.0 110.952 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.482 HG21 ' HG2' ' A' ' 7' ' ' LYS . 3.2 p -81.03 -34.09 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 120.805 -1.185 . . . . 0.0 110.169 -179.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.432 ' C ' ' O ' ' A' ' 104' ' ' VAL . 7.5 p -42.99 134.09 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.031 -1.043 . . . . 0.0 109.621 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.642 ' O ' ' ND2' ' A' ' 107' ' ' ASN . 4.9 pt20 -141.03 26.6 2.02 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 106' ' ' GLN . 7.8 m120 -144.51 39.72 1.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.498 -0.751 . . . . 0.0 109.603 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.59 ' O ' ' CD1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -142.0 149.09 39.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.0 . . . . 0.0 109.766 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.404 ' HB1' ' NZ ' ' A' ' 75' ' ' LYS . . . -87.19 -33.5 19.34 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.636 ' NZ ' ' CZ ' ' A' ' 112' ' ' PHE . 0.7 OUTLIER -162.32 155.66 20.49 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.279 -0.888 . . . . 0.0 109.353 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -104.45 156.36 18.0 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.319 -0.863 . . . . 0.0 109.171 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.636 ' CZ ' ' NZ ' ' A' ' 110' ' ' LYS . 24.1 m-85 -139.67 157.39 45.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.207 -0.933 . . . . 0.0 109.895 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -119.99 109.22 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.559 -0.713 . . . . 0.0 109.305 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.469 HG23 ' HB3' ' A' ' 119' ' ' GLU . 35.3 mm -98.73 152.02 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.444 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.8 t -139.39 7.23 2.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.265 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.403 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.8 OUTLIER -142.0 155.26 45.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.511 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -70.21 -34.92 73.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.969 . . . . 0.0 109.613 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.699 ' HE2' ' OE2' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -75.28 -16.29 60.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 0.0 109.103 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.58 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.7 mp0 -86.4 -4.85 59.24 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.35 -0.844 . . . . 0.0 109.513 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.455 ' HG ' HG21 ' A' ' 114' ' ' ILE . 0.7 OUTLIER -99.65 8.74 44.12 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.255 -0.903 . . . . 0.0 108.965 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.699 ' OE2' ' HE2' ' A' ' 118' ' ' LYS . 63.7 mt-10 -63.68 139.05 58.73 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 0.0 109.505 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.744 ' OE1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -52.23 -50.62 61.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ASP . . . . . 0.744 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.4 OUTLIER -59.05 -42.47 90.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.895 -1.128 . . . . 0.0 109.687 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.58 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 63.7 t80 -55.48 -44.73 76.78 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.009 0.909 . . . . 0.0 109.064 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -74.47 -25.23 19.21 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -67.49 -52.64 36.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.242 -0.911 . . . . 0.0 109.188 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -20.11 65.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.242 -0.911 . . . . 0.0 109.234 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -71.65 -42.54 67.41 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.307 -0.871 . . . . 0.0 109.271 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.496 HD21 ' HB2' ' A' ' 77' ' ' ALA . 3.7 mt -73.88 -51.64 15.55 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 109.042 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -49.63 -23.44 1.7 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.209 -0.932 . . . . 0.0 109.287 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.41 -59.17 3.17 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.238 -0.914 . . . . 0.0 109.376 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 50.64 69.11 0.67 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.309 -0.87 . . . . 0.0 109.474 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.517 ' C ' ' H ' ' A' ' 135' ' ' ALA . . . -167.64 76.74 0.12 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -61.91 3.74 0.64 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.568 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . 55.43 45.01 26.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.161 -1.2 . . . . 0.0 109.437 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -46.51 -12.54 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.259 -0.901 . . . . 0.0 109.472 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.568 ' N ' ' O ' ' A' ' 135' ' ' ALA . 0.2 OUTLIER -58.26 -15.5 10.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.232 -0.917 . . . . 0.0 109.451 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -93.36 -48.61 6.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.326 -0.859 . . . . 0.0 109.472 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 47.32 85.64 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.226 -0.921 . . . . 0.0 109.475 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 -78.33 9.76 3.61 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.311 -0.868 . . . . 0.0 109.519 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.73 7.68 35.6 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.248 -0.907 . . . . 0.0 109.537 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 118.022 -0.99 . . . . 0.0 109.413 179.961 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mmm . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' A' ' 3' ' ' THR . . . -149.36 122.09 8.66 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.52 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.919 HG21 ' OD1' ' A' ' 97' ' ' ASP . 7.2 m 59.35 147.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.292 -0.88 . . . . 0.0 109.475 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HB2' HG23 ' A' ' 35' ' ' THR . 45.4 mttp -123.67 129.06 50.54 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 109.532 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.503 HG23 ' O ' ' A' ' 5' ' ' ILE . 2.8 tp -107.66 125.37 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.478 -0.764 . . . . 0.0 109.315 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.4 m-20 -97.61 43.39 1.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.208 -0.932 . . . . 0.0 109.293 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -42.32 -18.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 109.53 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 6' ' ' ASP . 34.4 mt-10 -55.89 -49.41 73.5 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 108.981 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -61.64 -66.58 0.51 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.353 -0.842 . . . . 0.0 108.939 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.6 m -44.83 -59.08 2.71 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.286 -0.884 . . . . 0.0 109.17 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.411 ' O ' ' C ' ' A' ' 12' ' ' ALA . 39.0 ttp180 -44.29 -56.06 4.45 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.034 -1.041 . . . . 0.0 109.744 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.74 -50.94 5.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.349 -0.845 . . . . 0.0 109.818 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.914 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -82.93 -35.07 26.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.377 -0.827 . . . . 0.0 110.262 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.704 ' CZ ' ' CE1' ' A' ' 61' ' ' PHE . 3.1 t80 -45.55 -65.79 0.49 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.367 -0.833 . . . . 0.0 110.302 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -70.7 -44.55 66.71 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.326 -0.859 . . . . 0.0 110.756 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.814 ' C ' HD13 ' A' ' 16' ' ' LEU . 0.2 OUTLIER -51.75 -40.82 60.94 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.928 -1.107 . . . . 0.0 109.396 -179.158 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 13' ' ' ALA . 98.3 t -51.31 -2.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 120.934 -1.103 . . . . 0.0 109.735 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.604 ' H ' ' C ' ' A' ' 16' ' ' LEU . 1.6 ttp180 -105.68 -0.61 25.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.114 -0.991 . . . . 0.0 109.127 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -84.71 153.5 23.04 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.245 -0.909 . . . . 0.0 109.724 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -64.03 -13.32 45.94 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.354 -0.841 . . . . 0.0 110.036 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.446 ' O ' ' OG ' ' A' ' 22' ' ' SER . . . -97.13 -80.96 1.56 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.678 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 99.0 p 52.99 -130.8 2.2 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.544 -0.974 . . . . 0.0 110.455 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.678 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 146.32 -45.76 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.819 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.704 ' O ' HG13 ' A' ' 24' ' ' VAL . 13.0 p -85.53 109.97 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.909 HG23 ' CD1' ' A' ' 26' ' ' TRP . 14.0 tt -56.86 -32.89 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.121 -0.987 . . . . 0.0 108.822 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.909 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.0 p-90 -160.7 149.67 16.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.229 -0.919 . . . . 0.0 109.876 178.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.553 HG11 ' CB ' ' A' ' 13' ' ' ALA . 15.1 m -117.55 134.73 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.487 -0.758 . . . . 0.0 109.263 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.575 HG23 ' CE3' ' A' ' 26' ' ' TRP . 40.8 p -124.9 143.63 50.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.362 -0.836 . . . . 0.0 109.901 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.654 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -121.74 163.6 18.81 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -140.89 146.67 37.77 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.359 -0.838 . . . . 0.0 109.835 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.609 ' OH ' HG23 ' A' ' 94' ' ' THR . 3.3 m-85 -58.99 98.71 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.417 -0.802 . . . . 0.0 110.092 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.488 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.1 OUTLIER -100.02 101.19 12.2 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.433 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 73.08 -122.18 7.96 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.13 22.72 15.51 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.352 -1.087 . . . . 0.0 110.352 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.514 HG23 ' HB2' ' A' ' 4' ' ' LYS . 4.0 m -138.39 153.88 48.92 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.081 -1.012 . . . . 0.0 110.197 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.519 ' O ' HG22 ' A' ' 36' ' ' ILE . 1.7 mp -109.79 103.77 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.411 -0.806 . . . . 0.0 109.139 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.2 m -135.83 154.95 78.21 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.164 -0.96 . . . . 0.0 109.771 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.407 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 88.1 Cg_exo -32.27 140.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 123.231 2.621 . . . . 0.0 112.546 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -141.88 -21.51 0.25 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.551 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.18 -178.89 6.07 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.389 -1.065 . . . . 0.0 109.622 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.741 HE22 ' CD2' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -157.74 179.81 8.86 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.627 0.727 . . . . 0.0 110.761 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.666 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -163.49 133.64 3.12 Favored Glycine 0 N--CA 1.485 1.951 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.456 ' O ' ' OD1' ' A' ' 44' ' ' ASP . . . -106.5 -8.56 17.01 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' A' ' 43' ' ' ALA . 59.5 m-20 -157.57 175.38 14.01 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.09 -41.37 67.39 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.806 -1.184 . . . . 0.0 109.267 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -51.58 -32.81 29.92 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.115 -0.991 . . . . 0.0 110.288 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.741 ' CD2' HE22 ' A' ' 41' ' ' GLN . 2.4 t60 -65.37 -15.42 62.55 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.93 -1.106 . . . . 0.0 109.955 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.579 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -82.09 -27.65 32.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.941 -1.099 . . . . 0.0 108.774 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.445 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.9 mt -79.97 -19.36 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.251 -0.906 . . . . 0.0 110.91 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.424 ' NE2' ' HG2' ' A' ' 51' ' ' GLN . 1.2 pp0? -87.02 -45.92 10.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.391 -1.443 . . . . 0.0 109.967 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.551 ' NE2' ' CG ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -105.32 56.66 0.68 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.261 -0.899 . . . . 0.0 110.884 -178.574 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 t -158.5 65.73 0.44 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.023 . . . . 0.0 109.501 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 55' ' ' ASP . 20.6 p -85.19 150.62 24.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -0.924 . . . . 0.0 109.915 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.495 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 2.5 p30 -51.58 -4.05 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.453 -0.779 . . . . 0.0 109.99 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.553 ' OD1' ' HB3' ' A' ' 85' ' ' ASP . 1.1 t0 -94.64 20.71 8.19 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.03 -1.044 . . . . 0.0 109.307 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.608 HG23 ' NH2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -138.72 151.2 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 0.0 109.654 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.679 ' HG2' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -130.98 131.54 44.45 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.485 -0.76 . . . . 0.0 109.801 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.759 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.66 175.52 3.43 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.995 -1.066 . . . . 0.0 110.504 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.568 ' O ' HG22 ' A' ' 28' ' ' THR . 1.0 OUTLIER -111.24 152.68 26.87 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.501 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -132.57 156.99 45.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.956 -1.09 . . . . 0.0 109.628 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.704 ' CE1' ' CZ ' ' A' ' 14' ' ' TYR . 64.5 t80 -149.46 97.02 2.58 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.217 -0.927 . . . . 0.0 109.361 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.01 156.53 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.307 -0.871 . . . . 0.0 109.467 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -79.66 113.06 17.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.427 -0.796 . . . . 0.0 109.01 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -92.59 154.65 18.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.256 -0.902 . . . . 0.0 109.72 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.2 t -78.26 163.4 25.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 108.975 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.9 -36.76 0.18 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.258 -0.901 . . . . 0.0 109.518 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -86.42 -97.05 0.81 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.667 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 5.3 p-10 -137.19 42.96 2.37 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -1.155 . . . . 0.0 109.541 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 68' ' ' ASP . . . 73.61 -26.85 0.19 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.24 -0.913 . . . . 0.0 109.483 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.496 ' H ' ' C ' ' A' ' 68' ' ' ASP . 0.4 OUTLIER -61.75 132.51 53.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.273 -0.892 . . . . 0.0 109.431 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.2 p -68.9 83.47 0.31 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.212 -0.93 . . . . 0.0 109.44 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -136.22 0.86 2.62 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.202 -0.936 . . . . 0.0 109.485 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -173.91 -68.09 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.238 -0.914 . . . . 0.0 109.484 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 62.26 149.6 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.199 -0.938 . . . . 0.0 109.416 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.451 ' HG3' ' HB2' ' A' ' 109' ' ' ALA . 6.9 ttmt -107.91 165.34 11.53 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.327 -0.858 . . . . 0.0 109.313 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.69 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 2.0 m-85 -133.25 128.65 36.32 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 109.813 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.78 167.06 23.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.341 -0.849 . . . . 0.0 110.581 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tt -117.41 157.65 25.84 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.492 HD11 HD12 ' A' ' 125' ' ' ILE . 3.1 mt -135.16 148.27 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.03 -1.044 . . . . 0.0 109.248 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.44 HG22 HD11 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -108.06 113.95 27.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.356 -0.84 . . . . 0.0 109.827 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.426 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 66.6 t-105 -94.66 111.17 22.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.018 -1.051 . . . . 0.0 109.604 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.44 HD11 HG22 ' A' ' 80' ' ' THR . 20.8 mm -112.24 92.99 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -53.29 149.29 12.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -94.35 35.24 1.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.32 -1.106 . . . . 0.0 109.554 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.553 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -153.29 25.97 0.53 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.679 HG21 ' HG2' ' A' ' 57' ' ' ARG . 4.0 p -98.11 159.63 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.15 -0.968 . . . . 0.0 109.725 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.4 p -71.9 -176.24 1.64 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.0 110.01 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.19 -18.19 63.28 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -46.4 -57.2 4.87 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.083 -1.245 . . . . 0.0 109.618 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 49.0 mm-40 -57.51 -30.97 65.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.208 -0.933 . . . . 0.0 109.23 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 6.6 tpt180 -45.33 -56.42 4.94 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.053 -1.03 . . . . 0.0 109.425 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.82 -35.2 38.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.823 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 10.2 mttt -69.66 -61.64 1.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.128 -0.982 . . . . 0.0 109.875 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.609 HG23 ' OH ' ' A' ' 31' ' ' TYR . 28.4 m -45.02 -49.83 11.11 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.0 109.65 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -51.66 -59.43 8.55 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 74.1 p -65.01 -48.29 74.44 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.014 -1.286 . . . . 0.0 111.173 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.919 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.0 OUTLIER -69.08 -41.1 77.97 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.82 -1.175 . . . . 0.0 111.617 -177.535 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.404 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -61.23 -22.18 64.55 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.768 -1.208 . . . . 0.0 109.459 -179.416 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 20.4 m -73.92 -44.85 53.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.227 -0.92 . . . . 0.0 109.426 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.455 ' N ' HD12 ' A' ' 100' ' ' LEU . 8.1 mp -59.13 -54.73 43.63 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.204 -0.935 . . . . 0.0 109.586 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -28.05 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.164 -0.96 . . . . 0.0 109.914 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.72 -37.93 73.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.14 -0.975 . . . . 0.0 109.784 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -22.39 60.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.158 -0.964 . . . . 0.0 109.732 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.797 ' O ' HG12 ' A' ' 104' ' ' VAL . 88.6 t -94.26 33.82 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.55 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.489 ' O ' HG12 ' A' ' 105' ' ' VAL . 12.1 t -131.75 98.93 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.298 -0.876 . . . . 0.0 109.873 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.595 ' O ' ' N ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -119.1 -41.4 2.75 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.722 ' N ' HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -63.9 41.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 119.936 -0.705 . . . . 0.0 110.073 -179.172 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.595 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -142.4 174.69 10.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.345 -0.847 . . . . 0.0 109.601 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.451 ' HB2' ' HG3' ' A' ' 75' ' ' LYS . . . -88.07 -56.76 3.19 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.205 -0.934 . . . . 0.0 109.5 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.514 ' CG ' ' N ' ' A' ' 111' ' ' GLU . 9.3 ttpp -162.37 167.17 24.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.294 -0.878 . . . . 0.0 109.33 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.514 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -104.37 154.06 20.3 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.192 -0.943 . . . . 0.0 108.968 179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -128.61 156.2 43.74 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.444 -0.785 . . . . 0.0 110.166 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.569 ' O ' HD13 ' A' ' 114' ' ' ILE . 33.4 t -115.16 143.11 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.711 HG21 ' CD2' ' A' ' 120' ' ' LEU . 18.8 mm -136.08 154.07 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.078 -1.013 . . . . 0.0 110.439 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 64.4 m -140.59 3.6 1.9 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.611 -0.681 . . . . 0.0 109.218 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 1.164 ' OD1' ' CD ' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -143.12 155.29 44.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.189 -0.945 . . . . 0.0 109.526 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -73.96 -33.25 63.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 109.824 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.61 -8.76 54.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.199 -0.938 . . . . 0.0 109.007 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 1.164 ' CD ' ' OD1' ' A' ' 116' ' ' ASP . 21.7 mt-10 -86.35 -0.48 56.0 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.711 ' CD2' HG21 ' A' ' 114' ' ' ILE . 2.6 mm? -94.71 1.29 55.49 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.214 -0.929 . . . . 0.0 108.814 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.45 145.77 54.96 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.538 -0.726 . . . . 0.0 109.701 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -62.33 -49.24 76.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 0.0 109.581 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.15 -21.94 15.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.0 109.852 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 67.5 t80 -83.31 -49.21 9.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.301 -0.874 . . . . 0.0 109.148 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.492 HD12 HD11 ' A' ' 79' ' ' ILE . 4.5 mm -71.94 -25.2 23.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -65.09 -52.39 55.83 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.198 -0.939 . . . . 0.0 108.729 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.3 t -58.74 -24.5 61.71 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.323 -0.861 . . . . 0.0 109.197 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.84 -40.65 65.57 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.295 -0.878 . . . . 0.0 109.268 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 75' ' ' LYS . 19.2 mt -73.64 -53.11 11.21 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.219 -0.925 . . . . 0.0 109.131 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 130' ' ' LYS . 11.3 mptt -60.35 -7.25 1.9 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.143 -0.973 . . . . 0.0 109.601 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.27 -60.21 2.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.908 . . . . 0.0 109.402 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -138.09 102.68 4.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.266 -0.896 . . . . 0.0 109.445 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -163.06 46.55 0.33 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.538 ' O ' ' N ' ' A' ' 136' ' ' ASN . . . -156.57 -74.86 0.02 OUTLIER Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.89 72.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.272 -1.134 . . . . 0.0 109.494 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.538 ' N ' ' O ' ' A' ' 134' ' ' GLY . 58.1 t30 -104.08 67.41 0.86 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.291 -0.881 . . . . 0.0 109.535 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.515 ' O ' ' CD1' ' A' ' 137' ' ' TYR . 0.4 OUTLIER -98.7 -36.96 9.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.273 -0.892 . . . . 0.0 109.466 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 140' ' ' GLN . 0.0 OUTLIER -42.99 -34.94 1.08 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.287 -0.883 . . . . 0.0 109.535 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 52.1 7.66 0.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.234 -0.916 . . . . 0.0 109.475 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 138' ' ' ASP . 1.0 OUTLIER -91.23 110.49 21.77 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.29 -0.881 . . . . 0.0 109.495 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.32 112.29 23.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.226 -0.922 . . . . 0.0 109.45 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.451 179.936 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.2 mtt . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.436 ' C ' ' OG1' ' A' ' 3' ' ' THR . . . -96.8 130.75 44.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.283 -0.886 . . . . 0.0 109.505 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.436 ' OG1' ' C ' ' A' ' 2' ' ' ALA . 0.1 OUTLIER 63.03 138.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.291 -0.881 . . . . 0.0 109.402 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -137.32 118.21 14.22 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.275 -0.891 . . . . 0.0 109.364 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.437 HG23 ' HG3' ' A' ' 7' ' ' LYS . 2.0 tt -110.79 142.72 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.404 -0.81 . . . . 0.0 109.615 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 8' ' ' GLU . 4.5 m-20 -93.4 40.84 1.07 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.189 -0.944 . . . . 0.0 109.154 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.482 ' HB3' HG11 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -40.17 -22.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.712 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.57 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.3 tt0 -50.32 -34.05 22.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.186 -0.946 . . . . 0.0 109.232 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.8 -60.25 2.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.357 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.89 -62.82 1.08 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.209 -0.932 . . . . 0.0 109.682 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.654 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 38.7 ttp180 -45.17 -53.66 7.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.951 -1.093 . . . . 0.0 109.221 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -58.29 8.49 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.339 -0.85 . . . . 0.0 109.757 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.543 ' HB3' HG11 ' A' ' 27' ' ' VAL . . . -58.55 -25.57 62.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.535 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -70.76 -48.31 55.02 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.368 -0.832 . . . . 0.0 109.492 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.499 ' N ' ' OD1' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -79.58 -11.06 59.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.272 -0.893 . . . . 0.0 109.555 -179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.416 ' HA ' HD12 ' A' ' 16' ' ' LEU . 6.6 tp -76.76 -29.01 55.93 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.265 -0.897 . . . . 0.0 109.212 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.696 HG12 HG13 ' A' ' 24' ' ' VAL . 0.8 OUTLIER -72.1 -1.57 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.298 -0.876 . . . . 0.0 109.194 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.512 ' CG ' ' O ' ' A' ' 18' ' ' ARG . 22.1 ttp180 -118.76 -1.03 11.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.535 -0.728 . . . . 0.0 109.188 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.3 OUTLIER -94.58 26.86 3.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.206 -0.934 . . . . 0.0 109.969 -179.57 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.532 ' C ' ' O ' ' A' ' 19' ' ' ASP . 4.9 m-20 29.55 35.53 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.766 -0.584 . . . . 0.0 110.406 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.595 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . -121.36 -76.1 0.41 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.596 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 37.1 t -67.97 -30.72 70.06 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.212 -1.169 . . . . 0.0 110.089 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 22' ' ' SER . . . 68.52 4.94 4.54 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.093 -1.004 . . . . 0.0 109.659 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.696 HG13 HG12 ' A' ' 17' ' ' VAL . 2.5 p -58.41 78.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.98 . . . . 0.0 108.94 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -41.02 -59.04 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 O-C-N 121.409 -0.807 . . . . 0.0 109.949 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.66 ' CE3' HG23 ' A' ' 28' ' ' THR . 27.0 p-90 -134.02 156.49 48.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.826 -1.171 . . . . 0.0 110.834 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.543 HG11 ' HB3' ' A' ' 13' ' ' ALA . 1.5 p -134.27 135.77 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.66 HG23 ' CE3' ' A' ' 26' ' ' TRP . 70.7 p -124.28 146.22 48.91 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.097 -1.002 . . . . 0.0 110.541 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.92 136.9 54.19 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 32' ' ' ASP . 26.9 ptt180 -113.47 146.1 40.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.487 -0.758 . . . . 0.0 109.982 -178.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.531 ' CD2' ' OE1' ' A' ' 90' ' ' GLN . 1.9 m-85 -41.21 98.63 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.565 -0.709 . . . . 0.0 109.781 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -97.1 101.76 13.4 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.853 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 55.83 -119.35 13.74 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.83 22.46 15.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.453 -1.028 . . . . 0.0 110.098 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 43.8 m -145.31 134.06 22.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.123 -0.986 . . . . 0.0 109.909 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.3 mp -78.98 113.45 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.284 -0.885 . . . . 0.0 108.997 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.41 150.5 72.59 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.286 -0.884 . . . . 0.0 109.871 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -35.53 146.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.895 2.397 . . . . 0.0 112.303 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.99 -38.64 0.15 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.754 ' CG ' HE22 ' A' ' 51' ' ' GLN . 3.5 m-20 -142.62 -179.38 6.27 Favored 'General case' 0 C--N 1.296 -1.761 0 O-C-N 121.714 -0.874 . . . . 0.0 109.285 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.621 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -158.12 -169.39 2.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.354 -0.841 . . . . 0.0 109.685 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.15 143.96 7.75 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 119.521 -1.323 . . . . 0.0 110.163 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.04 0.29 29.65 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.463 ' C ' HD13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.29 170.71 19.37 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.425 ' O ' ' C ' ' A' ' 46' ' ' GLN . 17.8 p90 -79.63 -39.72 30.89 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.625 -1.297 . . . . 0.0 109.03 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 45' ' ' TYR . 4.8 mm100 -42.42 -33.84 0.73 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.078 -1.014 . . . . 0.0 109.994 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.518 ' NE2' ' OE1' ' A' ' 50' ' ' GLN . 2.1 t-160 -61.74 -41.75 98.06 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.82 -1.175 . . . . 0.0 109.108 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.648 ' CE1' HD13 ' A' ' 120' ' ' LEU . 0.1 OUTLIER -47.67 -33.22 6.56 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.404 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mt -64.63 -42.11 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.158 -0.964 . . . . 0.0 109.111 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.574 ' NE2' ' O ' ' A' ' 50' ' ' GLN . 5.3 tm0? -86.96 -12.62 47.0 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.754 HE22 ' CG ' ' A' ' 40' ' ' ASP . 24.6 mm-40 -109.97 67.25 0.64 Allowed 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.313 1.054 . . . . 0.0 110.472 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.694 ' SG ' HD11 ' A' ' 58' ' ' LEU . 1.2 m 158.61 59.19 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.009 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.524 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.4 p -77.41 164.02 25.86 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.966 -1.084 . . . . 0.0 109.707 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.3 OUTLIER -65.46 -4.52 5.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.632 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.29 14.46 31.89 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.282 -0.886 . . . . 0.0 109.504 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 53' ' ' THR . 2.5 p -138.18 157.14 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.236 -0.915 . . . . 0.0 109.745 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.522 ' CD ' ' N ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -134.76 129.03 34.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.554 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.752 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.7 pp -172.49 172.73 4.25 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 110.294 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.515 ' O ' HG22 ' A' ' 28' ' ' THR . 2.7 m-85 -104.34 153.55 20.92 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.117 -0.99 . . . . 0.0 108.846 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.427 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.05 156.93 46.48 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.404 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 47.7 t80 -148.91 96.54 2.57 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -113.5 159.27 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.31 -0.868 . . . . 0.0 109.609 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.583 ' NE ' ' OG ' ' A' ' 74' ' ' SER . 1.1 ttt-85 -84.7 140.65 31.14 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.299 -0.875 . . . . 0.0 108.735 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -123.62 156.05 36.55 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.807 . . . . 0.0 110.221 -179.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.6 t -77.22 135.11 38.46 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.1 m -109.61 37.79 2.53 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.476 -0.765 . . . . 0.0 109.5 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.588 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 173.01 108.98 0.22 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.486 ' OD1' ' NH1' ' A' ' 126' ' ' ARG . 1.0 OUTLIER -43.12 91.72 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.225 -1.162 . . . . 0.0 109.506 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.588 ' N ' ' O ' ' A' ' 67' ' ' GLY . . . 55.09 43.04 30.24 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.0 109.438 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 19.6 ttt -146.64 156.95 43.59 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.331 -0.856 . . . . 0.0 109.482 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.57 148.53 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.211 -0.93 . . . . 0.0 109.488 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -99.14 -24.84 14.73 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.9 mtm180 -58.11 174.93 0.24 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 0.0 109.432 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.583 ' OG ' ' NE ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -138.39 171.28 14.61 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.295 -0.878 . . . . 0.0 109.444 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.93 155.38 19.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.84 . . . . 0.0 109.311 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.442 ' O ' ' N ' ' A' ' 109' ' ' ALA . 93.8 m-85 -134.02 120.25 20.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.394 -0.816 . . . . 0.0 109.746 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.74 167.2 22.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.604 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tt -121.18 155.42 34.59 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.483 HD11 ' CD1' ' A' ' 125' ' ' ILE . 3.2 mm -134.7 143.06 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.168 -0.957 . . . . 0.0 109.046 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.42 HG23 ' CD2' ' A' ' 59' ' ' PHE . 2.7 m -104.14 117.06 33.36 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 109.674 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.5 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -92.97 111.49 23.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.048 -1.033 . . . . 0.0 109.69 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -110.11 93.12 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.323 -0.861 . . . . 0.0 108.746 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.07 158.7 3.0 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -96.95 19.88 12.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.295 -1.121 . . . . 0.0 109.734 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -132.16 26.81 4.53 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.865 . . . . 0.0 109.215 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.485 HG22 ' HD2' ' A' ' 57' ' ' ARG . 4.1 t -91.21 160.98 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.357 -0.839 . . . . 0.0 110.094 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 t -93.37 -161.32 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.379 -0.825 . . . . 0.0 108.985 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -20.62 59.19 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.969 -1.253 . . . . 0.0 109.969 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.59 -64.65 0.71 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.987 -1.302 . . . . 0.0 110.023 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.531 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 41.6 mm-40 -56.75 -30.22 63.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.8 tmm_? -49.6 -59.51 3.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.798 -1.188 . . . . 0.0 109.633 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.38 -39.88 27.58 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.174 -0.954 . . . . 0.0 109.796 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.447 ' C ' ' OH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -60.27 -65.3 0.71 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 109.515 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 51.1 m -45.16 -43.11 9.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.0 109.572 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.07 -60.45 3.5 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.8 m -66.05 -47.95 72.65 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.118 -1.225 . . . . 0.0 111.075 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -68.77 -42.86 76.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.78 -1.2 . . . . 0.0 111.386 -177.8 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -25.12 53.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.595 -1.316 . . . . 0.0 108.745 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 96.1 m -81.33 -20.7 40.14 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 100' ' ' LEU . 53.2 mt -78.98 -63.79 1.33 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.44 -0.787 . . . . 0.0 109.185 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -50.3 -33.11 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.975 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.985 ' HE2' ' HG2' ' A' ' 111' ' ' GLU . 1.4 tttm -75.07 -42.37 57.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.269 -0.894 . . . . 0.0 109.751 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.31 -39.33 85.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.168 -0.957 . . . . 0.0 110.203 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.482 HG11 ' HB3' ' A' ' 7' ' ' LYS . 12.8 p -78.16 -25.68 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.07 -1.018 . . . . 0.0 109.926 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 102' ' ' LYS . 1.0 OUTLIER -42.8 138.4 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.105 -0.997 . . . . 0.0 109.518 -179.927 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -144.29 20.07 1.73 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.072 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -143.18 41.16 1.5 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.896 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.566 ' O ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -142.52 158.0 44.14 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.032 . . . . 0.0 109.867 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -93.6 -34.34 13.35 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.354 -0.842 . . . . 0.0 109.446 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -162.27 159.54 25.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.871 . . . . 0.0 109.314 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.985 ' HG2' ' HE2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -104.2 150.69 24.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.199 -0.938 . . . . 0.0 109.337 -179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 79' ' ' ILE . 62.0 m-85 -133.84 157.62 45.46 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.451 -0.78 . . . . 0.0 109.701 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.6 t -121.19 142.47 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.455 HD12 ' OE1' ' A' ' 119' ' ' GLU . 1.8 mm -137.26 156.59 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.899 . . . . 0.0 110.058 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.482 ' O ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -140.64 9.19 2.2 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.607 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -158.79 157.05 30.88 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.825 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -79.74 -18.96 49.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.918 -1.114 . . . . 0.0 110.209 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -62.8 -50.06 72.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.087 -1.008 . . . . 0.0 110.428 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.607 ' OE2' ' N ' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -80.79 4.74 18.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 0.0 110.279 -179.098 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.648 HD13 ' CE1' ' A' ' 48' ' ' PHE . 0.7 OUTLIER -96.38 16.62 17.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.007 -1.058 . . . . 0.0 108.405 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -74.63 154.6 38.45 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.66 -0.65 . . . . 0.0 109.78 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.41 -48.22 74.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.424 -0.798 . . . . 0.0 109.49 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 1.3 p30 -56.97 -41.59 78.62 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 109.658 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CG ' ' O ' ' A' ' 119' ' ' GLU . 15.4 t80 -60.36 -48.0 83.62 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.094 0.95 . . . . 0.0 109.093 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.483 ' CD1' HD11 ' A' ' 79' ' ' ILE . 1.4 mm -71.22 -40.15 74.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.486 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 33.5 ttp180 -62.14 -53.37 56.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.203 -0.935 . . . . 0.0 109.039 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -15.06 13.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.384 -0.822 . . . . 0.0 109.49 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.422 ' OE2' ' CZ ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -83.52 -37.24 23.32 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.21 -0.931 . . . . 0.0 109.358 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.593 ' C ' ' H ' ' A' ' 131' ' ' LYS . 46.8 mt -69.08 -39.72 78.88 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.193 -0.942 . . . . 0.0 108.631 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.908 ' HZ2' ' HB2' ' A' ' 132' ' ' ALA . 0.2 OUTLIER -53.23 -5.43 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.137 -0.977 . . . . 0.0 108.645 179.135 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.593 ' H ' ' C ' ' A' ' 129' ' ' LEU . 11.2 tttt 60.93 102.56 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.71 0.767 . . . . 0.0 109.477 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.908 ' HB2' ' HZ2' ' A' ' 130' ' ' LYS . . . -141.54 -33.88 0.49 Allowed 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.551 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -95.92 138.72 14.1 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . 153.78 170.01 19.35 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 69.78 43.07 0.99 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.215 -1.168 . . . . 0.0 109.459 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.465 ' O ' ' ND2' ' A' ' 136' ' ' ASN . 1.1 p-10 43.29 18.1 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.171 -0.956 . . . . 0.0 109.401 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.585 ' N ' ' O ' ' A' ' 135' ' ' ALA . 10.6 t80 -75.71 5.28 6.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.282 -0.886 . . . . 0.0 109.471 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.486 ' C ' ' H ' ' A' ' 140' ' ' GLN . 66.5 m-20 -90.66 -72.07 0.59 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.259 -0.901 . . . . 0.0 109.456 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.21 4.86 0.43 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.304 -0.873 . . . . 0.0 109.437 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.486 ' H ' ' C ' ' A' ' 138' ' ' ASP . 17.4 mt-30 53.62 -175.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 109.41 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 5.4 p -83.1 -171.34 3.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.287 -0.883 . . . . 0.0 109.444 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 118.08 -0.962 . . . . 0.0 109.498 -179.993 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.683 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 15.5 ttt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.683 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 74.47 -60.26 0.53 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.867 . . . . 0.0 109.466 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.671 HG21 ' OD1' ' A' ' 97' ' ' ASP . 2.4 m -90.3 151.27 21.56 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.299 -0.876 . . . . 0.0 109.395 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.581 ' HB3' HG23 ' A' ' 35' ' ' THR . 0.1 OUTLIER -138.26 125.1 21.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.185 -0.947 . . . . 0.0 109.44 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.3 137.25 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.391 -0.818 . . . . 0.0 109.694 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.558 ' O ' ' N ' ' A' ' 8' ' ' GLU . 6.3 t70 -64.04 -44.61 91.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -0.89 . . . . 0.0 109.381 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.682 ' HD3' HG21 ' A' ' 104' ' ' VAL . 1.5 mtmt 63.89 -50.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.445 -0.785 . . . . 0.0 110.184 179.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 6' ' ' ASP . 10.9 mt-10 -51.8 -49.29 63.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.111 -0.993 . . . . 0.0 109.809 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.69 -69.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 109.999 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.613 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 4.1 m -46.08 -65.34 0.56 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.22 -0.925 . . . . 0.0 110.125 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.519 HH11 ' HG3' ' A' ' 11' ' ' ARG . 0.9 OUTLIER -44.78 -58.39 3.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.985 -1.072 . . . . 0.0 110.144 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.95 -45.28 78.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.131 -0.981 . . . . 0.0 110.049 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.425 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -75.88 -17.02 59.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.058 -1.026 . . . . 0.0 110.183 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-30 -74.27 -52.96 10.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.125 -0.984 . . . . 0.0 109.539 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.723 ' ND2' ' NH2' ' A' ' 18' ' ' ARG . 4.1 m120 -71.93 -13.32 61.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 109.42 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.543 HD23 HG22 ' A' ' 24' ' ' VAL . 4.8 tp -70.87 -47.99 56.23 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.356 -0.84 . . . . 0.0 109.575 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 14' ' ' TYR . 18.7 m -64.97 -14.0 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.218 -0.926 . . . . 0.0 109.563 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.723 ' NH2' ' ND2' ' A' ' 15' ' ' ASN . 20.1 ttm180 -71.83 -26.58 62.44 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.267 -0.896 . . . . 0.0 109.508 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.481 ' O ' ' O ' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -59.84 -144.76 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.226 -0.921 . . . . 0.0 109.449 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -111.62 51.95 0.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.445 -0.785 . . . . 0.0 109.302 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 79.85 64.16 1.91 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.9 t -85.14 -49.09 8.53 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.316 -1.108 . . . . 0.0 109.605 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.543 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . -178.89 -157.9 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.198 -0.938 . . . . 0.0 109.71 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.806 HG23 ' O ' ' A' ' 24' ' ' VAL . 9.1 m 21.5 69.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-O 120.821 0.343 . . . . 0.0 111.378 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.796 HG23 ' CD1' ' A' ' 26' ' ' TRP . 13.0 tt -46.77 -31.06 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 120.743 -1.223 . . . . 0.0 108.08 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.796 ' CD1' HG23 ' A' ' 25' ' ' ILE . 22.8 p-90 -157.16 147.63 21.22 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.295 -0.878 . . . . 0.0 109.372 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.425 HG21 ' HB3' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -112.84 135.09 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.334 -0.854 . . . . 0.0 110.091 -179.381 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.624 HG22 ' O ' ' A' ' 59' ' ' PHE . 47.5 p -131.18 133.88 45.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.48 -0.762 . . . . 0.0 109.73 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.613 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.44 167.28 14.06 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.488 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -140.89 143.75 34.84 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 119.231 -0.987 . . . . 0.0 109.813 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.638 ' OH ' HG23 ' A' ' 94' ' ' THR . 5.6 m-85 -50.37 98.68 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.544 -0.723 . . . . 0.0 109.744 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.66 101.35 13.04 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.08 -122.71 13.39 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.89 22.31 16.09 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.46 -1.023 . . . . 0.0 110.227 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.581 HG23 ' HB3' ' A' ' 4' ' ' LYS . 35.4 m -146.6 136.0 22.86 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.066 -1.021 . . . . 0.0 109.694 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mp -77.56 115.8 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.108 -0.995 . . . . 0.0 108.768 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -135.31 154.13 78.47 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.244 -0.91 . . . . 0.0 109.822 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -39.67 141.59 0.55 Allowed 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.752 2.301 . . . . 0.0 112.388 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.28 -40.8 0.17 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.568 ' CG ' ' H ' ' A' ' 41' ' ' GLN . 14.8 t70 -144.19 179.65 7.09 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.75 -0.853 . . . . 0.0 108.83 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.624 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -140.81 177.11 8.26 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.406 -0.808 . . . . 0.0 110.546 -179.069 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.611 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -112.19 85.14 0.38 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.592 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -113.77 43.74 1.75 Allowed 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER 143.41 125.55 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.911 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -54.65 -53.86 49.23 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 0.0 109.551 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.462 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 5.1 mp0 -48.54 -20.22 0.41 Allowed 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.2 -0.938 . . . . 0.0 109.79 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.584 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -71.77 -34.01 69.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.195 -0.94 . . . . 0.0 109.225 179.655 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.592 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -56.03 -40.12 73.0 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.433 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.475 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.3 mt -58.74 -55.08 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.902 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.421 ' O ' ' OE1' ' A' ' 50' ' ' GLN . 1.2 tm0? -73.27 7.15 2.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.013 -1.055 . . . . 0.0 108.361 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.585 ' O ' HG23 ' A' ' 53' ' ' THR . 52.2 mm-40 -116.07 -75.73 0.58 Allowed 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.17 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.552 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 2.5 m -65.82 48.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.125 -0.984 . . . . 0.0 109.496 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 51' ' ' GLN . 0.7 OUTLIER -73.75 172.5 11.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.181 -0.949 . . . . 0.0 109.739 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.58 ' OD1' ' N ' ' A' ' 55' ' ' ASP . 1.1 p30 -55.27 -48.27 74.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.273 -0.892 . . . . 0.0 109.763 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.58 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.5 OUTLIER -76.28 42.21 0.26 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 -179.874 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.561 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 96.0 t -148.19 147.18 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 109.836 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -138.38 120.91 16.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.404 -0.81 . . . . 0.0 109.516 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.748 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.5 pp -172.86 175.97 3.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.076 -1.015 . . . . 0.0 110.462 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.624 ' O ' HG22 ' A' ' 28' ' ' THR . 3.9 m-85 -104.46 152.03 22.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.984 -1.072 . . . . 0.0 108.807 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.441 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.43 152.04 51.87 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.965 -1.085 . . . . 0.0 109.017 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.461 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 39.5 t80 -150.82 96.93 2.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.076 . . . . 0.0 109.498 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.55 154.89 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.248 -0.907 . . . . 0.0 108.949 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -80.7 113.29 18.79 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.359 -0.838 . . . . 0.0 108.983 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.546 ' CE2' ' HB3' ' A' ' 77' ' ' ALA . 12.5 m-85 -93.87 155.8 16.99 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.88 . . . . 0.0 109.661 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.97 149.62 34.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.164 -0.96 . . . . 0.0 108.97 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.547 HG22 ' H ' ' A' ' 68' ' ' ASP . 90.5 m -109.96 -78.07 0.59 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.438 -0.789 . . . . 0.0 109.473 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.49 -31.06 6.32 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.547 ' H ' HG22 ' A' ' 66' ' ' THR . 0.5 OUTLIER -55.4 -62.61 1.56 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.257 -1.143 . . . . 0.0 109.494 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -45.03 153.7 0.18 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.208 -0.932 . . . . 0.0 109.521 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.7 ttm -47.3 -42.82 21.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.252 -0.905 . . . . 0.0 109.42 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.91 -139.28 0.33 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.454 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 73' ' ' ARG . 16.4 mttt -99.77 -77.14 0.53 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.197 -0.939 . . . . 0.0 109.557 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.524 ' CB ' ' O ' ' A' ' 72' ' ' LYS . 12.2 ttp180 77.04 -44.0 0.45 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.255 -0.903 . . . . 0.0 109.444 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 0.4 OUTLIER 73.49 153.06 0.13 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.313 -0.867 . . . . 0.0 109.487 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.616 ' HG2' HD22 ' A' ' 129' ' ' LEU . 0.6 OUTLIER -104.74 157.69 17.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.393 -0.817 . . . . 0.0 109.89 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -133.26 119.73 20.18 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.458 -0.776 . . . . 0.0 109.054 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.698 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -144.09 156.8 44.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.091 -1.006 . . . . 0.0 110.947 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.6 tt -106.57 157.29 17.79 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.55 HG23 HD11 ' A' ' 114' ' ' ILE . 36.9 mt -137.36 133.26 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 120.92 -1.113 . . . . 0.0 109.066 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.44 HG23 ' CD2' ' A' ' 59' ' ' PHE . 1.3 m -95.72 117.76 31.12 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.165 -0.959 . . . . 0.0 109.653 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.561 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -93.02 110.38 21.85 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.089 -1.007 . . . . 0.0 109.729 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -105.21 93.01 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -58.09 156.35 19.76 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.524 ' O ' ' N ' ' A' ' 86' ' ' VAL . 2.9 mm-40 -78.72 -51.47 9.76 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -1.163 . . . . 0.0 109.63 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -67.0 39.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.183 -0.948 . . . . 0.0 109.57 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.524 ' N ' ' O ' ' A' ' 84' ' ' GLU . 92.8 t -96.63 157.3 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.23 -0.919 . . . . 0.0 109.725 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.434 ' N ' HG12 ' A' ' 86' ' ' VAL . 9.2 p -99.38 -161.49 0.88 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.324 -0.86 . . . . 0.0 109.461 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.03 -15.97 68.54 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.8 mp -46.93 -54.27 10.44 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.073 -1.251 . . . . 0.0 109.408 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.54 ' CD ' ' N ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -57.29 -35.16 69.46 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.865 . . . . 0.0 109.165 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.661 ' CG ' HH11 ' A' ' 91' ' ' ARG . 0.0 OUTLIER -47.6 -62.72 1.31 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.061 -1.024 . . . . 0.0 109.961 -179.358 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.09 -40.52 19.72 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.13 -0.981 . . . . 0.0 110.132 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.444 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 56.8 mmtt -61.66 -59.05 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 0.0 110.312 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.638 HG23 ' OH ' ' A' ' 31' ' ' TYR . 27.3 m -55.78 -49.09 74.1 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.962 -1.086 . . . . 0.0 109.516 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.47 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.87 -62.12 2.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.7 p -64.91 -49.26 71.11 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.118 -1.225 . . . . 0.0 111.104 -178.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.671 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.3 OUTLIER -66.85 -42.18 86.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.914 -1.116 . . . . 0.0 111.401 -177.824 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -22.64 63.55 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.623 -1.298 . . . . 0.0 109.201 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -82.3 -21.47 36.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.368 -0.833 . . . . 0.0 108.812 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.4 mt -83.46 -61.94 1.71 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.397 -0.815 . . . . 0.0 109.272 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.614 HG13 ' N ' ' A' ' 102' ' ' LYS . 8.6 p -46.78 -46.85 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.743 ' HD3' ' OE2' ' A' ' 111' ' ' GLU . 3.3 ttmt -66.31 -44.29 83.82 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.232 -0.918 . . . . 0.0 109.615 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -47.98 -68.53 0.18 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.221 -0.925 . . . . 0.0 110.153 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.682 HG21 ' HD3' ' A' ' 7' ' ' LYS . 14.5 p -74.16 42.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -0.947 . . . . 0.0 110.05 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -121.0 167.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.417 -0.802 . . . . 0.0 109.712 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.577 ' C ' ' H ' ' A' ' 108' ' ' PHE . 3.1 pt20 -177.21 -29.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.551 HD22 HH21 ' A' ' 18' ' ' ARG . 0.2 OUTLIER -66.77 26.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.528 -0.732 . . . . 0.0 109.738 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.577 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -139.82 154.29 47.31 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.0 109.478 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.43 -31.98 14.4 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.476 -0.765 . . . . 0.0 109.778 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -162.35 152.37 16.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.743 ' OE2' ' HD3' ' A' ' 102' ' ' LYS . 7.8 pt-20 -104.87 156.9 17.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.894 . . . . 0.0 108.682 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -142.28 158.35 43.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.943 -1.098 . . . . 0.0 110.894 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.764 ' O ' HD13 ' A' ' 114' ' ' ILE . 4.1 p -117.01 158.12 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.764 HD13 ' O ' ' A' ' 113' ' ' VAL . 4.4 mm -138.07 154.5 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.083 -1.011 . . . . 0.0 110.314 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.63 -0.12 2.92 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.487 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -155.08 155.35 33.92 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.381 -0.824 . . . . 0.0 109.072 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -74.39 -24.75 59.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.005 . . . . 0.0 109.912 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.528 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 1.0 OUTLIER -68.82 -14.52 63.08 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.135 -0.978 . . . . 0.0 109.144 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.585 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 10.2 mm-40 -87.09 4.1 43.51 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.767 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.673 HD23 HD11 ' A' ' 125' ' ' ILE . 9.2 mt -107.18 31.17 5.57 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.278 -0.889 . . . . 0.0 109.577 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 118' ' ' LYS . 1.6 mt-10 -79.27 138.08 37.63 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.044 -1.035 . . . . 0.0 109.903 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -46.0 -53.75 9.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.095 -1.003 . . . . 0.0 109.477 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ASP . . . . . 0.733 ' OD1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -60.78 -38.6 85.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.277 -0.89 . . . . 0.0 109.735 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.585 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 20.8 t80 -61.06 -48.18 82.94 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.208 -0.932 . . . . 0.0 109.157 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.673 HD11 HD23 ' A' ' 120' ' ' LEU . 2.0 mm -58.96 -21.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.562 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -82.24 -44.97 15.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.129 -0.982 . . . . 0.0 109.838 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.7 t -58.33 -30.94 67.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.246 -0.909 . . . . 0.0 109.842 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -85.24 -38.93 18.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.582 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.698 HD21 ' HB2' ' A' ' 77' ' ' ALA . 6.1 mt -68.2 -27.82 66.72 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.122 -0.986 . . . . 0.0 109.295 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -49.45 -46.39 47.82 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.172 -0.955 . . . . 0.0 109.106 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 132' ' ' ALA . 5.0 tmtt? -169.86 -53.12 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.437 -0.79 . . . . 0.0 109.267 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 131' ' ' LYS . . . 45.62 92.95 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.44 -0.787 . . . . 0.0 109.514 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -101.89 -43.94 2.01 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.664 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . 101.89 -94.67 1.23 Allowed Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.569 -1.413 . . . . 0.0 109.569 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 73.38 -1.36 3.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.264 -1.139 . . . . 0.0 109.519 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 19.3 p30 -95.66 41.94 1.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.178 -0.952 . . . . 0.0 109.536 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.541 ' CG ' ' O ' ' A' ' 137' ' ' TYR . 66.2 t80 -144.16 29.16 1.33 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.24 -0.913 . . . . 0.0 109.484 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.432 ' CG ' ' N ' ' A' ' 139' ' ' ALA . 2.6 p-10 -162.59 -42.98 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.271 -0.893 . . . . 0.0 109.493 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.432 ' N ' ' CG ' ' A' ' 138' ' ' ASP . . . -101.15 31.87 3.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.561 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -50.34 -50.14 51.88 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.272 -0.892 . . . . 0.0 109.48 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.7 t -51.9 151.48 3.52 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.215 -0.928 . . . . 0.0 109.474 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.077 -0.963 . . . . 0.0 109.445 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.703 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 3.9 mtp . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 77.09 14.9 1.9 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.255 -0.903 . . . . 0.0 109.502 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 2' ' ' ALA . 4.1 m 60.83 135.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.234 -0.916 . . . . 0.0 109.412 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.63 ' CB ' HG23 ' A' ' 35' ' ' THR . 23.1 mttp -128.77 124.06 34.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.466 -0.771 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.597 HD12 HG21 ' A' ' 36' ' ' ILE . 3.0 tp -107.59 130.32 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.379 -0.825 . . . . 0.0 109.476 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -102.86 60.89 0.79 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.148 -0.97 . . . . 0.0 109.451 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.711 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -45.52 -14.11 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.065 -1.022 . . . . 0.0 109.51 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 6' ' ' ASP . 4.0 mt-10 -55.53 -50.74 69.19 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.199 -0.938 . . . . 0.0 109.443 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.29 -58.19 6.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 109.383 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.596 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.3 m -57.05 -65.17 0.66 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 109.776 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.436 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 9.7 tmm_? -44.62 -57.68 3.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.981 -1.075 . . . . 0.0 109.959 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.64 -33.05 53.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.169 -0.957 . . . . 0.0 109.366 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.2 -39.69 25.03 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.75 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.667 ' CZ ' ' CG ' ' A' ' 61' ' ' PHE . 1.5 m-85 -50.27 -49.23 53.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.23 -0.919 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.516 ' N ' ' OD1' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -80.13 -17.42 52.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.099 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 16' ' ' LEU . 33.1 tp -70.61 -22.72 62.51 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.733 HG11 ' O ' ' A' ' 25' ' ' ILE . 4.5 m -92.0 -3.09 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.91 . . . . 0.0 109.529 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.653 ' CG ' HH11 ' A' ' 18' ' ' ARG . 0.0 OUTLIER -63.21 -4.05 2.23 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.317 -0.865 . . . . 0.0 109.382 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.559 ' C ' ' H ' ' A' ' 21' ' ' GLY . 0.7 OUTLIER -97.09 158.8 15.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.326 -0.859 . . . . 0.0 109.6 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.401 ' HA ' HH22 ' A' ' 63' ' ' ARG . 0.0 OUTLIER -68.37 16.56 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 109.536 179.895 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.559 ' H ' ' C ' ' A' ' 19' ' ' ASP . . . 147.71 75.93 0.02 OUTLIER Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.175 -1.57 . . . . 0.0 109.175 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.99 -46.2 4.95 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.266 -1.138 . . . . 0.0 109.864 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . -166.85 -141.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.036 -1.04 . . . . 0.0 110.405 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 24' ' ' VAL . 2.4 m -39.18 123.53 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.512 -0.742 . . . . 0.0 110.494 -179.294 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.733 ' O ' HG11 ' A' ' 17' ' ' VAL . 0.3 OUTLIER -63.09 -55.0 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.694 ' CE3' HG23 ' A' ' 28' ' ' THR . 17.7 p-90 -128.86 165.13 21.61 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.579 ' CG1' HG21 ' A' ' 24' ' ' VAL . 27.8 m -133.48 133.52 57.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.24 -0.912 . . . . 0.0 109.278 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.694 HG23 ' CE3' ' A' ' 26' ' ' TRP . 72.5 p -125.87 137.83 53.76 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.283 -0.885 . . . . 0.0 109.65 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.657 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.65 163.56 16.27 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 178.475 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.675 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -141.0 142.22 34.27 Favored 'General case' 0 C--N 1.294 -1.831 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.538 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.417 ' C ' ' O ' ' A' ' 30' ' ' ARG . 6.6 m-85 -42.76 98.55 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.486 -0.759 . . . . 0.0 109.887 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 30' ' ' ARG . 1.3 t0 -97.97 101.59 13.12 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 57.68 -120.18 20.12 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.076 -1.61 . . . . 0.0 109.076 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.67 22.94 15.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -1.06 . . . . 0.0 110.292 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.63 HG23 ' CB ' ' A' ' 4' ' ' LYS . 2.8 m -143.47 134.95 26.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.107 -0.996 . . . . 0.0 110.014 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.597 HG21 HD12 ' A' ' 5' ' ' ILE . 1.6 mp -84.44 110.27 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.302 -0.874 . . . . 0.0 108.969 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 m -135.8 158.58 73.78 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.277 -0.889 . . . . 0.0 109.662 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -50.74 135.78 42.23 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.754 2.303 . . . . 0.0 111.585 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.465 ' HA3' HH11 ' A' ' 30' ' ' ARG . . . -130.4 -22.96 1.04 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.627 ' OD1' ' NE2' ' A' ' 51' ' ' GLN . 1.8 m-20 -142.68 -178.35 5.74 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.492 -1.005 . . . . 0.0 109.425 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.597 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -163.22 -176.99 5.1 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.435 -0.79 . . . . 0.0 109.764 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.407 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -157.27 141.92 8.23 Favored Glycine 0 N--CA 1.489 2.174 0 C-N-CA 119.549 -1.31 . . . . 0.0 109.9 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.3 -8.8 18.03 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -157.52 174.83 14.78 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.574 ' CZ ' ' CE2' ' A' ' 48' ' ' PHE . 31.0 t80 -73.68 -10.64 59.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.277 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.631 ' HA ' HD11 ' A' ' 49' ' ' ILE . 46.0 mm-40 -75.61 -30.29 59.51 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.187 -0.946 . . . . 0.0 110.636 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.533 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -79.36 -4.0 48.87 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.609 -1.307 . . . . 0.0 110.044 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.583 ' CZ ' HD13 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -83.13 -51.51 7.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.835 -1.166 . . . . 0.0 110.193 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.756 ' N ' HD12 ' A' ' 49' ' ' ILE . 0.1 OUTLIER -63.03 -32.66 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 120.876 -1.14 . . . . 0.0 109.137 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.93 -21.5 60.87 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.627 ' NE2' ' OD1' ' A' ' 40' ' ' ASP . 28.9 mm-40 -96.46 -15.1 21.92 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.527 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.565 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 7.5 m -117.92 52.44 1.0 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.414 -0.804 . . . . 0.0 110.228 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 55' ' ' ASP . 23.3 p -72.48 166.87 21.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.911 -1.118 . . . . 0.0 109.266 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -70.47 12.21 0.27 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 109.768 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 53' ' ' THR . 5.9 m-20 -120.49 24.82 10.15 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.398 -0.814 . . . . 0.0 109.749 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.438 HG13 ' CD1' ' A' ' 81' ' ' TRP . 6.8 p -148.11 162.79 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.577 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.487 ' O ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -138.38 126.09 22.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.261 -0.899 . . . . 0.0 110.178 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.743 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.0 pp -172.85 173.81 3.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.165 -0.96 . . . . 0.0 110.0 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.56 ' O ' HG22 ' A' ' 28' ' ' THR . 0.6 OUTLIER -107.19 154.52 21.08 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.22 -0.925 . . . . 0.0 108.739 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.483 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -134.74 157.53 46.47 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.166 -0.959 . . . . 0.0 109.458 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.667 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 85.8 t80 -149.85 96.6 2.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.269 -0.895 . . . . 0.0 109.27 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.5 158.12 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.253 -0.904 . . . . 0.0 109.305 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.401 HH22 ' HA ' ' A' ' 20' ' ' ASP . 34.1 ttp180 -84.39 127.25 33.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.194 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -104.22 155.93 18.32 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 109.761 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.8 m -79.78 143.35 34.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.355 -0.841 . . . . 0.0 109.108 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.8 m -110.1 54.51 0.66 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.457 -0.777 . . . . 0.0 109.362 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.594 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 94.95 103.1 1.85 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.421 ' C ' ' O ' ' A' ' 67' ' ' GLY . 0.2 OUTLIER -43.14 91.46 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.206 -1.173 . . . . 0.0 109.331 -179.897 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.594 ' N ' ' O ' ' A' ' 67' ' ' GLY . . . -163.73 4.3 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.218 -0.926 . . . . 0.0 109.57 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.53 ' C ' ' H ' ' A' ' 72' ' ' LYS . 4.2 ttt 43.26 55.41 4.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.257 -0.902 . . . . 0.0 109.45 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.785 ' OG ' ' HG2' ' A' ' 73' ' ' ARG . 0.9 OUTLIER -71.08 30.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 0.0 109.514 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.53 ' H ' ' C ' ' A' ' 70' ' ' MET . 11.4 tttt 55.82 22.23 5.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.524 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.785 ' HG2' ' OG ' ' A' ' 71' ' ' SER . 11.2 ptm180 -173.02 126.48 0.45 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.577 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.94 -161.9 0.85 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.387 -0.821 . . . . 0.0 109.336 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.34 152.46 28.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.355 -0.84 . . . . 0.0 109.44 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.667 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 1.7 m-85 -134.17 126.46 29.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.411 -0.806 . . . . 0.0 109.683 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.64 159.32 43.0 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.794 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.572 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -113.08 155.84 24.19 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 120' ' ' LEU . 2.0 mt -138.06 135.68 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.915 -1.116 . . . . 0.0 109.121 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.3 m -95.93 120.24 35.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.565 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 64.9 t-105 -92.86 111.32 22.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.028 -1.045 . . . . 0.0 109.878 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -107.52 92.88 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.505 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -61.64 147.36 48.15 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.19 -14.1 60.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.31 -1.112 . . . . 0.0 109.582 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.59 37.02 1.41 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 109.492 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 83' ' ' GLY . 43.6 t -102.79 160.47 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.477 ' N ' HG12 ' A' ' 86' ' ' VAL . 14.0 m -91.64 -170.29 2.55 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.373 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -18.1 64.07 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 90' ' ' GLN . 8.0 mt -51.08 -69.79 0.1 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.15 -1.206 . . . . 0.0 109.5 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.552 ' N ' ' CD ' ' A' ' 90' ' ' GLN . 0.9 OUTLIER -44.61 -33.94 1.98 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 109.292 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.45 ' HA ' ' HE ' ' A' ' 91' ' ' ARG . 1.1 tpm_? -45.62 -61.69 1.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.693 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.7 -37.24 42.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.193 -0.942 . . . . 0.0 109.487 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.413 ' O ' ' C ' ' A' ' 94' ' ' THR . 0.1 OUTLIER -64.75 -66.31 0.56 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.943 . . . . 0.0 109.834 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.499 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 95.6 m -44.74 -40.68 6.22 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.25 -0.906 . . . . 0.0 109.562 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.489 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -51.12 -57.22 11.68 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 35.0 p -67.92 -47.99 67.2 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.957 -1.32 . . . . 0.0 110.909 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.59 ' OD2' HD13 ' A' ' 36' ' ' ILE . 9.6 t0 -69.66 -45.37 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.816 -1.177 . . . . 0.0 111.03 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.499 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -55.38 -24.26 28.87 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.774 -1.17 . . . . 0.0 108.604 -179.734 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.3 OUTLIER -67.23 -50.24 61.43 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.338 -0.851 . . . . 0.0 108.79 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 100' ' ' LEU . 10.4 mp -51.33 -54.67 24.01 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.292 -0.88 . . . . 0.0 109.499 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.467 HG22 HD11 ' A' ' 5' ' ' ILE . 31.2 t -48.94 -74.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.148 -0.97 . . . . 0.0 109.945 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 101' ' ' VAL . 32.8 mtmt -43.13 -48.96 6.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.152 -0.968 . . . . 0.0 109.681 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.58 -57.37 12.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.921 . . . . 0.0 110.045 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.783 ' O ' HG12 ' A' ' 104' ' ' VAL . 97.5 t -75.56 40.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 109.911 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.461 ' O ' HG12 ' A' ' 105' ' ' VAL . 2.2 t -138.23 113.04 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.098 -1.001 . . . . 0.0 109.863 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.621 ' O ' ' N ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -124.2 -30.24 3.47 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 9.3 m-20 -61.21 35.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.822 -0.549 . . . . 0.0 110.214 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.621 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -149.71 -178.06 6.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.066 -1.021 . . . . 0.0 110.135 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.96 -62.76 1.29 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.414 -0.804 . . . . 0.0 109.925 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.534 ' CB ' ' NZ ' ' A' ' 110' ' ' LYS . 5.6 ttpm? -147.4 173.9 12.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.22 -0.925 . . . . 0.0 109.6 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.489 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -104.62 155.43 18.85 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.932 . . . . 0.0 109.192 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -135.43 150.67 49.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.272 -0.893 . . . . 0.0 110.069 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.8 p -116.29 147.26 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 115' ' ' SER . 27.5 mm -138.5 156.56 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.188 -0.945 . . . . 0.0 110.375 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.403 ' O ' ' OG ' ' A' ' 115' ' ' SER . 0.3 OUTLIER -140.75 6.03 2.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.584 ' OD1' ' N ' ' A' ' 117' ' ' ARG . 43.3 t0 -150.14 155.36 39.67 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.866 . . . . 0.0 109.409 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.584 ' N ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -79.04 -28.39 43.23 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.197 -0.939 . . . . 0.0 110.047 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -73.99 -14.74 61.07 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.603 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -86.41 4.63 38.67 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -0.821 . . . . 0.0 109.744 -179.928 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.796 HD23 HD11 ' A' ' 125' ' ' ILE . 7.2 mt -114.12 29.48 7.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.362 -0.837 . . . . 0.0 109.652 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 122' ' ' GLU . 4.0 mm-40 -76.83 141.83 40.51 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.351 -0.843 . . . . 0.0 109.287 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 121' ' ' GLU . 1.3 mt-10 -41.31 -52.4 3.46 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.187 -0.945 . . . . 0.0 109.742 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.2 -10.88 45.81 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.307 -0.87 . . . . 0.0 110.868 -179.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.603 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 18.0 t80 -86.34 -48.81 8.15 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.737 -1.227 . . . . 0.0 109.359 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.796 HD11 HD23 ' A' ' 120' ' ' LEU . 4.1 mm -76.24 -20.56 15.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.411 HH21 ' HA2' ' A' ' 67' ' ' GLY . 61.7 ttt180 -73.34 -53.35 10.99 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.27 -0.894 . . . . 0.0 108.951 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.65 -18.66 65.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.315 -0.866 . . . . 0.0 109.315 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.404 ' CG ' ' O ' ' A' ' 124' ' ' PHE . 5.7 mm-40 -72.36 -43.09 64.53 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.191 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.563 ' C ' ' H ' ' A' ' 131' ' ' LYS . 9.1 mt -66.51 -36.39 82.59 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -55.39 -4.67 0.1 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.563 ' H ' ' C ' ' A' ' 129' ' ' LEU . 12.8 ttpt 61.37 104.45 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 CA-C-O 121.72 0.771 . . . . 0.0 109.395 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -159.96 31.11 0.18 Allowed 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.61 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -141.27 -68.99 0.03 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 75.4 138.14 0.63 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.454 ' O ' ' O ' ' A' ' 136' ' ' ASN . . . -145.27 68.9 1.23 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.235 -1.156 . . . . 0.0 109.476 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.473 ' N ' ' OD1' ' A' ' 136' ' ' ASN . 0.4 OUTLIER 49.31 96.95 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.237 -0.915 . . . . 0.0 109.454 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -140.8 -35.81 0.48 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.323 -0.861 . . . . 0.0 109.438 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -143.6 40.65 1.43 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.297 -0.877 . . . . 0.0 109.45 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -149.86 37.56 0.72 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.295 -0.878 . . . . 0.0 109.453 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -69.79 101.17 1.65 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.238 -0.914 . . . . 0.0 109.45 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.67 -12.61 60.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.279 -0.888 . . . . 0.0 109.473 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.437 179.978 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.678 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.678 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 76.05 159.32 0.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.419 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m -158.02 147.57 19.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.21 -0.932 . . . . 0.0 109.457 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 35' ' ' THR . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.724 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.621 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.423 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.587 ' O ' ' NE ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -79.65 -7.96 58.9 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.574 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -92.34 158.09 16.28 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.24 -0.913 . . . . 0.0 109.444 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.69 38.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.202 -0.936 . . . . 0.0 109.815 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . 174.35 -91.77 0.09 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.729 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.7 OUTLIER 74.15 -55.11 0.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -1.064 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.729 ' HB3' ' O ' ' A' ' 22' ' ' SER . . . 84.16 52.82 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.804 ' O ' HG22 ' A' ' 24' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.709 HG22 ' O ' ' A' ' 42' ' ' GLY . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.688 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.621 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.771 ' OH ' HG23 ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.447 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.709 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.614 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.446 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.591 ' O ' HG23 ' A' ' 53' ' ' THR . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.2 mm-40 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.463 ' SG ' HD21 ' A' ' 120' ' ' LEU . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.521 ' HD2' ' H ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.553 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.825 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.633 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER -109.82 77.29 1.04 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.1 130.36 4.24 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.737 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 0.0 OUTLIER -79.08 91.66 4.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -1.133 . . . . 0.0 109.481 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.7 ' HB2' ' O ' ' A' ' 68' ' ' ASP . . . 164.83 132.08 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.23 -0.919 . . . . 0.0 109.445 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.552 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 6.3 tpt 54.88 -82.78 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.46 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.578 ' N ' ' O ' ' A' ' 69' ' ' ALA . 1.7 m 54.01 80.27 0.12 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.42 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -86.53 -11.39 51.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.235 -0.916 . . . . 0.0 109.56 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.8 mtt180 -159.33 96.27 1.29 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.248 -0.907 . . . . 0.0 109.634 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.825 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -50.45 -178.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.714 ' HD3' HD13 ' A' ' 129' ' ' LEU . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.454 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.62 ' CG2' HD12 ' A' ' 114' ' ' ILE . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.441 HG23 ' CD2' ' A' ' 59' ' ' PHE . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 80' ' ' THR . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.525 ' N ' ' CD ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' THR . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.771 HG23 ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' ALA . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.415 ' OD2' HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 104' ' ' VAL . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.427 ' O ' HG12 ' A' ' 105' ' ' VAL . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.558 ' O ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.62 HD12 ' CG2' ' A' ' 79' ' ' ILE . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.661 ' H ' ' CD ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.714 HD13 ' HD3' ' A' ' 75' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.33 -7.73 0.26 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.549 ' H ' ' C ' ' A' ' 129' ' ' LEU . 7.3 ttpp 61.26 104.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.797 0.808 . . . . 0.0 109.338 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -139.25 -32.35 0.66 Allowed 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -47.33 162.43 0.26 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -137.58 167.15 24.88 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . -162.87 24.47 0.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -1.164 . . . . 0.0 109.501 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.503 ' C ' ' H ' ' A' ' 138' ' ' ASP . 1.0 OUTLIER 65.94 -74.02 0.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 109.567 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' ALA . 74.4 t80 53.05 6.74 0.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.276 -0.89 . . . . 0.0 109.438 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.503 ' H ' ' C ' ' A' ' 136' ' ' ASN . 12.6 t0 -165.29 -87.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -145.86 83.48 1.64 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.527 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 48.84 -99.52 0.06 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.241 -0.912 . . . . 0.0 109.432 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -173.36 4.06 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.911 . . . . 0.0 109.438 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.515 -179.982 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.0 mmt . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.401 ' H ' ' H ' ' A' ' 3' ' ' THR . . . -158.37 -18.42 0.08 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.259 -0.901 . . . . 0.0 109.442 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.401 ' H ' ' H ' ' A' ' 2' ' ' ALA . 0.3 OUTLIER -95.54 145.78 24.95 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.335 -0.853 . . . . 0.0 109.455 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -139.61 118.44 12.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.236 -0.915 . . . . 0.0 109.47 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.506 HG23 ' HG3' ' A' ' 7' ' ' LYS . 1.3 tt -113.84 147.21 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.522 -0.736 . . . . 0.0 109.653 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -94.37 63.0 2.97 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.218 -0.926 . . . . 0.0 109.111 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.746 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.49 -26.16 60.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 109.55 -179.705 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.87 -46.6 71.36 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.278 -0.889 . . . . 0.0 109.407 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -60.86 -68.12 0.34 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.947 . . . . 0.0 109.582 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.76 -58.9 2.79 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.164 -0.96 . . . . 0.0 109.859 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 8.5 ttt180 -44.41 -59.57 2.35 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.925 -1.109 . . . . 0.0 110.219 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.75 -37.0 65.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.937 . . . . 0.0 110.038 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.483 ' CB ' HG11 ' A' ' 27' ' ' VAL . . . -83.6 -19.17 36.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.096 -1.003 . . . . 0.0 110.117 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.505 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -72.62 -53.89 10.62 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.111 -0.993 . . . . 0.0 109.569 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.608 HD21 HH21 ' A' ' 18' ' ' ARG . 3.1 m120 -68.51 -25.68 65.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.221 -0.924 . . . . 0.0 109.547 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.524 ' O ' ' CB ' ' A' ' 22' ' ' SER . 1.3 tp -57.64 -61.33 2.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.233 -0.917 . . . . 0.0 109.329 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 14' ' ' TYR . 21.4 m -51.84 -19.41 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 109.733 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.608 HH21 HD21 ' A' ' 15' ' ' ASN . 8.0 ttm180 -56.19 -31.22 63.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.169 -0.957 . . . . 0.0 109.507 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -75.1 160.27 30.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.571 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -63.92 60.43 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.308 -0.87 . . . . 0.0 109.614 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.588 ' O ' ' N ' ' A' ' 23' ' ' ALA . . . 133.59 -73.56 0.45 Allowed Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.729 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.6 OUTLIER 54.31 -82.12 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.531 -0.982 . . . . 0.0 109.457 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 161.12 -172.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.509 -0.744 . . . . 0.0 109.389 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.494 ' C ' ' O ' ' A' ' 23' ' ' ALA . 4.8 m 31.94 74.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.846 -0.534 . . . . 0.0 110.686 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.754 HG22 ' O ' ' A' ' 42' ' ' GLY . 6.3 tt -44.49 -38.4 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.089 -1.007 . . . . 0.0 108.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.753 ' CD1' HG23 ' A' ' 25' ' ' ILE . 43.5 p-90 -150.57 162.51 40.5 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.397 -0.814 . . . . 0.0 109.25 178.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.483 HG11 ' CB ' ' A' ' 13' ' ' ALA . 26.8 m -133.26 139.4 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 109.187 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.584 HG23 ' CE3' ' A' ' 26' ' ' TRP . 60.7 p -128.98 139.93 51.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.34 -0.85 . . . . 0.0 110.179 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.18 133.36 51.58 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 16.9 ptt180 -108.59 147.41 31.85 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.852 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.475 ' HH ' ' CG ' ' A' ' 97' ' ' ASP . 14.5 m-85 -47.55 98.66 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.565 -0.709 . . . . 0.0 109.766 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -96.02 101.97 13.7 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.7 -120.23 21.47 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.99 22.25 16.23 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.326 -1.103 . . . . 0.0 110.228 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.0 m -145.33 136.99 25.35 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.805 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.9 mp -81.62 114.35 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.221 -0.924 . . . . 0.0 108.979 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -135.46 152.0 75.7 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 109.717 -179.56 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 97.0 Cg_exo -33.12 145.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 122.971 2.447 . . . . 0.0 112.252 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -137.44 -36.45 0.17 Allowed Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.934 ' CG ' HE22 ' A' ' 51' ' ' GLN . 2.7 m-20 -142.67 -179.81 6.54 Favored 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.731 -0.864 . . . . 0.0 109.419 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.618 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -157.03 179.8 8.94 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.995 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.754 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.27 133.09 2.89 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.45 -3.04 24.52 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.82 175.97 12.92 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -42.42 70.55 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 120.677 -1.264 . . . . 0.0 108.946 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.41 ' N ' ' CD ' ' A' ' 46' ' ' GLN . 2.1 mp0 -43.09 -35.54 1.34 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.305 -0.872 . . . . 0.0 110.674 -179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.529 ' CD2' HE22 ' A' ' 41' ' ' GLN . 1.0 OUTLIER -62.95 -22.56 66.88 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.013 -1.054 . . . . 0.0 109.532 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.553 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -68.44 -23.97 64.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.202 -0.936 . . . . 0.0 108.718 179.489 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.522 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.4 mt -76.57 -54.02 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.582 -0.699 . . . . 0.0 109.927 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.455 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 13.1 tm0? -65.56 -2.94 3.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.934 HE22 ' CG ' ' A' ' 40' ' ' ASP . 26.8 mm-40 -106.13 -37.54 6.56 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.11 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.595 ' O ' HG23 ' A' ' 53' ' ' THR . 0.1 OUTLIER -49.32 132.43 20.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.287 -0.883 . . . . 0.0 109.644 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.595 HG23 ' O ' ' A' ' 52' ' ' CYS . 20.6 p -160.07 115.29 2.34 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.4 -0.813 . . . . 0.0 110.555 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.74 11.36 0.1 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.628 -0.67 . . . . 0.0 109.587 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.538 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -122.71 16.68 10.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.495 -0.753 . . . . 0.0 109.324 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.532 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -135.72 154.26 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.4 -0.813 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.728 ' H ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.59 131.73 43.52 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.355 -0.841 . . . . 0.0 109.519 -179.936 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.765 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.8 pp -172.69 172.39 4.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.974 -1.078 . . . . 0.0 110.317 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.567 ' N ' ' CD1' ' A' ' 59' ' ' PHE . 2.2 m-85 -106.01 153.96 21.29 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -135.83 156.9 48.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.02 -1.05 . . . . 0.0 109.556 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 53.9 t80 -148.19 97.57 2.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.358 -0.839 . . . . 0.0 109.21 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.503 ' O ' ' CE1' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -115.74 150.97 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -80.47 108.6 14.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.276 -0.89 . . . . 0.0 108.96 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CE1' ' O ' ' A' ' 62' ' ' VAL . 14.9 m-85 -86.72 155.76 20.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.324 -0.86 . . . . 0.0 109.805 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.55 161.04 28.19 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.298 -0.876 . . . . 0.0 108.848 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.9 t -109.75 43.8 1.28 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 0.0 109.466 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.676 ' N ' ' NZ ' ' A' ' 130' ' ' LYS . . . 84.61 -69.49 3.32 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -137.43 80.98 1.84 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.286 -1.126 . . . . 0.0 109.489 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.89 159.0 0.19 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.241 -0.912 . . . . 0.0 109.482 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.722 ' O ' ' OG ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -138.21 1.78 2.25 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.267 -0.896 . . . . 0.0 109.434 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.722 ' OG ' ' O ' ' A' ' 70' ' ' MET . 4.8 m 163.04 -110.52 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.334 -0.854 . . . . 0.0 109.461 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.448 ' CE ' ' HD2' ' A' ' 18' ' ' ARG . 20.7 tttt -103.32 80.57 1.84 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.243 -0.91 . . . . 0.0 109.451 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 -138.75 -91.13 0.2 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.309 -0.87 . . . . 0.0 109.478 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.27 167.07 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.2 -0.938 . . . . 0.0 109.438 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.647 ' HD2' HD22 ' A' ' 129' ' ' LEU . 2.6 mmtp -104.59 154.98 19.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.846 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.582 ' O ' ' N ' ' A' ' 109' ' ' ALA . 84.3 m-85 -133.22 118.8 19.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.151 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.426 ' HB1' ' O ' ' A' ' 110' ' ' LYS . . . -144.36 167.18 23.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.139 -0.976 . . . . 0.0 111.024 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.436 ' HG ' ' N ' ' A' ' 79' ' ' ILE . 9.2 tp -111.87 151.64 28.87 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.568 HG23 HG12 ' A' ' 114' ' ' ILE . 22.1 mt -130.35 129.54 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.99 -1.069 . . . . 0.0 108.758 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.476 HG22 HD11 ' A' ' 82' ' ' ILE . 5.7 m -95.86 115.05 26.86 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.532 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 62.8 t-105 -92.97 111.23 22.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.101 -0.999 . . . . 0.0 109.651 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.476 HD11 HG22 ' A' ' 80' ' ' THR . 24.9 mm -104.1 93.19 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 108.906 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.59 137.6 39.7 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -79.55 53.22 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.286 -1.126 . . . . 0.0 109.653 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -141.22 -30.99 0.6 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.17 -0.956 . . . . 0.0 109.81 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.444 HG23 ' H ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -64.83 156.81 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.188 -0.945 . . . . 0.0 109.623 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.453 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 54.9 p -96.04 -127.89 0.14 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.363 -0.836 . . . . 0.0 109.587 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.453 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.17 -18.33 63.01 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.53 ' O ' ' CG ' ' A' ' 93' ' ' LYS . 3.4 mt -46.14 -48.9 17.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.971 -1.311 . . . . 0.0 109.934 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -66.03 -26.39 67.49 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.145 -0.972 . . . . 0.0 109.908 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -56.39 -67.2 0.32 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.966 -1.084 . . . . 0.0 110.188 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.77 -44.43 49.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.18 -0.95 . . . . 0.0 110.131 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 89' ' ' LEU . 12.3 mmtm -55.82 -65.19 0.64 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.208 -0.933 . . . . 0.0 110.102 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 8.0 m -50.78 -49.68 57.75 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.131 -0.981 . . . . 0.0 109.679 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -46.94 -61.1 4.58 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 m -63.91 -51.12 65.94 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.031 -1.276 . . . . 0.0 111.78 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -74.57 -39.76 62.07 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.725 -1.234 . . . . 0.0 111.784 -177.183 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.588 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -55.36 -26.36 40.65 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 120.585 -1.322 . . . . 0.0 108.642 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.45 -30.34 47.42 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 97' ' ' ASP . 2.0 mt -71.18 -64.57 0.89 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.439 -0.788 . . . . 0.0 109.339 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.603 HG13 ' N ' ' A' ' 102' ' ' LYS . 9.9 p -41.9 -45.46 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.209 -0.932 . . . . 0.0 110.008 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.603 ' N ' HG13 ' A' ' 101' ' ' VAL . 6.1 ttpt -65.99 -39.4 90.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.271 -0.893 . . . . 0.0 109.597 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.66 -51.27 70.11 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.251 -0.906 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.639 ' O ' HG12 ' A' ' 104' ' ' VAL . 40.2 t -77.64 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.099 -1.001 . . . . 0.0 109.954 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.507 HG12 ' O ' ' A' ' 102' ' ' LYS . 1.7 p -112.57 136.55 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.338 -0.851 . . . . 0.0 109.513 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -145.65 24.67 1.36 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.373 -0.829 . . . . 0.0 108.928 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.521 ' ND2' ' OD1' ' A' ' 15' ' ' ASN . 2.8 t-20 -135.39 -25.32 1.33 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.432 -0.792 . . . . 0.0 110.141 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.505 ' C ' ' CD1' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -76.86 171.1 15.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.388 -179.561 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -117.79 -31.74 5.04 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.77 ' HE2' ' CE1' ' A' ' 112' ' ' PHE . 3.2 ttpm? -162.46 152.05 15.89 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.507 -0.746 . . . . 0.0 109.16 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -104.43 155.45 18.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.127 -0.983 . . . . 0.0 109.088 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.77 ' CE1' ' HE2' ' A' ' 110' ' ' LYS . 9.4 m-85 -133.88 156.44 48.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.366 -0.834 . . . . 0.0 109.819 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.765 ' O ' HG13 ' A' ' 113' ' ' VAL . 13.0 p -113.44 97.41 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.695 HG23 ' HB3' ' A' ' 119' ' ' GLU . 30.4 mm -100.32 142.44 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.228 -0.92 . . . . 0.0 109.888 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.1 m -141.1 15.6 2.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.308 -0.87 . . . . 0.0 109.548 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.9 155.34 46.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.034 -1.041 . . . . 0.0 110.124 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -69.71 -36.25 75.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 109.709 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -76.3 -17.36 59.48 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.695 ' HB3' HG23 ' A' ' 114' ' ' ILE . 15.3 mm-40 -83.25 -15.84 48.71 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.475 ' HG ' HG21 ' A' ' 114' ' ' ILE . 0.5 OUTLIER -103.44 30.95 4.62 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.736 ' CG ' ' H ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -74.54 -175.31 2.35 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.448 0.642 . . . . 0.0 110.367 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.476 ' C ' ' OE2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -84.06 -44.65 13.88 Favored 'General case' 0 C--N 1.295 -1.771 0 O-C-N 121.36 -0.838 . . . . 0.0 110.145 177.272 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -85.79 -44.89 12.11 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 114.884 1.438 . . . . 0.0 114.884 -175.521 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.736 ' H ' ' CG ' ' A' ' 121' ' ' GLU . 18.9 t80 -49.94 -40.79 44.79 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 119.874 -1.766 . . . . 0.0 108.93 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.573 ' H ' ' CD ' ' A' ' 121' ' ' GLU . 1.1 mm -78.21 -27.17 14.53 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.831 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.451 ' HG2' ' HZ3' ' A' ' 130' ' ' LYS . 25.4 ttp180 -67.48 -45.66 75.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.981 -1.074 . . . . 0.0 109.719 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.534 ' O ' ' N ' ' A' ' 130' ' ' LYS . 0.8 OUTLIER -63.2 -66.51 0.53 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.488 ' CD ' ' CE2' ' A' ' 112' ' ' PHE . 24.0 pt-20 -41.97 -33.2 0.52 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.489 -0.757 . . . . 0.0 109.318 -178.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.647 HD22 ' HD2' ' A' ' 75' ' ' LYS . 4.8 mt -79.08 -32.17 44.64 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.111 -0.993 . . . . 0.0 109.056 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.676 ' NZ ' ' N ' ' A' ' 67' ' ' GLY . 14.2 mttp -69.17 -32.11 71.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.261 -0.9 . . . . 0.0 108.951 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.719 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 0.3 OUTLIER -53.08 -65.85 0.49 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.29 -0.881 . . . . 0.0 109.523 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.719 ' HB3' ' O ' ' A' ' 131' ' ' LYS . . . 76.97 -27.83 0.18 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.264 -0.897 . . . . 0.0 109.504 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.583 ' O ' ' N ' ' A' ' 135' ' ' ALA . . . 67.23 29.76 74.74 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.437 ' C ' ' O ' ' A' ' 133' ' ' GLY . . . 43.1 -91.84 0.01 OUTLIER Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.583 ' N ' ' O ' ' A' ' 133' ' ' GLY . . . -157.28 -60.91 0.09 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.295 -1.121 . . . . 0.0 109.528 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -143.45 -136.5 0.1 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.243 -0.911 . . . . 0.0 109.452 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.505 ' O ' ' CD2' ' A' ' 137' ' ' TYR . 58.5 t80 55.93 26.57 9.96 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.277 -0.889 . . . . 0.0 109.453 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 139' ' ' ALA . 16.8 p-10 -166.17 23.25 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.27 -0.894 . . . . 0.0 109.493 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.435 ' C ' ' O ' ' A' ' 138' ' ' ASP . . . -43.38 -60.43 1.72 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.315 -0.866 . . . . 0.0 109.544 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -145.44 93.47 2.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.23 -0.918 . . . . 0.0 109.531 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.5 t -147.05 1.91 0.77 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.243 -0.911 . . . . 0.0 109.494 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.458 -179.949 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.472 ' O ' ' O ' ' A' ' 3' ' ' THR . . . -93.68 117.19 29.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.171 -0.956 . . . . 0.0 109.41 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.472 ' O ' ' O ' ' A' ' 2' ' ' ALA . 0.2 OUTLIER 60.45 137.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.216 -0.928 . . . . 0.0 109.444 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.475 ' CB ' HG23 ' A' ' 35' ' ' THR . 11.0 mmtm -133.49 121.79 22.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.38 -0.825 . . . . 0.0 109.314 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.461 HG23 ' H ' ' A' ' 7' ' ' LYS . 2.2 tp -107.44 136.18 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.408 -0.807 . . . . 0.0 109.747 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 8' ' ' GLU . 1.9 p-10 -97.84 41.84 1.11 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -0.891 . . . . 0.0 109.041 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.652 ' NZ ' HG13 ' A' ' 101' ' ' VAL . 1.3 mmtm -42.01 -18.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.346 -0.846 . . . . 0.0 109.898 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.5 mt-10 -51.96 -35.65 46.83 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.201 -0.937 . . . . 0.0 109.484 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.411 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -75.81 -63.67 1.25 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.863 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.65 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.49 -57.96 3.26 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.09 -1.006 . . . . 0.0 109.888 -179.439 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.65 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -44.16 -59.58 2.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.997 -1.064 . . . . 0.0 110.001 -179.098 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.9 -37.22 71.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.128 -0.983 . . . . 0.0 109.632 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.452 ' CB ' HG11 ' A' ' 27' ' ' VAL . . . -81.13 -11.13 59.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.12 -0.988 . . . . 0.0 109.852 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.476 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -81.88 -51.85 7.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.11 -0.994 . . . . 0.0 109.734 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 11' ' ' ARG . 0.1 OUTLIER -77.72 -11.25 59.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.247 -0.908 . . . . 0.0 109.64 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.479 ' C ' ' H ' ' A' ' 18' ' ' ARG . 58.3 tp -78.41 -50.06 12.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.207 -0.933 . . . . 0.0 109.34 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 m -57.87 -2.87 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.306 -0.871 . . . . 0.0 109.484 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.479 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.51 17.41 0.87 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.593 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -103.5 146.84 27.92 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.338 -0.851 . . . . 0.0 109.491 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.487 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 12.5 p30 -62.27 68.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.318 -0.864 . . . . 0.0 109.624 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . 86.16 70.84 1.31 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.712 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -100.88 -61.8 1.32 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -1.109 . . . . 0.0 109.421 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.712 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 163.5 169.47 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.0 109.472 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.816 ' O ' HG12 ' A' ' 24' ' ' VAL . 55.7 t 53.02 57.16 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.269 -0.894 . . . . 0.0 109.482 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.79 HG23 ' CD1' ' A' ' 26' ' ' TRP . 6.9 tt -47.16 -36.45 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.906 -1.121 . . . . 0.0 108.865 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.79 ' CD1' HG23 ' A' ' 25' ' ' ILE . 57.9 p-90 -148.27 151.57 35.66 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.784 -1.197 . . . . 0.0 109.671 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.452 HG11 ' CB ' ' A' ' 13' ' ' ALA . 2.4 m -112.35 163.36 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.31 -0.869 . . . . 0.0 109.701 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.463 HG22 HD23 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -145.47 129.37 17.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.177 -0.952 . . . . 0.0 110.482 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.97 119.66 27.21 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 25.0 ptt180 -101.73 144.83 29.94 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -48.44 98.55 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.532 -0.73 . . . . 0.0 109.753 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -92.67 101.95 14.36 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.962 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.95 -119.28 15.55 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.094 -1.603 . . . . 0.0 109.094 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.34 24.95 12.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.546 -0.973 . . . . 0.0 110.146 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.475 HG23 ' CB ' ' A' ' 4' ' ' LYS . 11.4 m -146.36 132.59 19.46 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.151 -0.968 . . . . 0.0 109.982 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.741 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.5 mp -79.95 113.12 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.175 -0.953 . . . . 0.0 108.515 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.46 152.13 75.92 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.196 -0.94 . . . . 0.0 110.16 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_exo -34.78 141.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.903 2.402 . . . . 0.0 112.471 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.78 -37.88 0.28 Allowed Glycine 0 N--CA 1.488 2.167 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -143.54 -179.49 6.47 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.661 ' H ' ' CD ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -130.79 -165.32 1.54 Allowed 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 121.49 0.662 . . . . 0.0 109.92 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.725 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -139.36 101.61 0.32 Allowed Glycine 0 C--N 1.299 -1.497 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.531 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -136.9 50.99 1.99 Allowed 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.531 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 3.6 m-20 155.63 106.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.68 ' OH ' ' HE1' ' A' ' 64' ' ' PHE . 23.0 t80 -53.78 -14.69 1.0 Allowed 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.403 ' N ' ' C ' ' A' ' 44' ' ' ASP . 43.5 mm-40 -85.15 -40.73 16.4 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.012 -1.055 . . . . 0.0 109.893 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.4 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -61.66 -37.15 82.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.872 . . . . 0.0 110.334 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.623 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -59.12 -47.68 84.37 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.849 -1.157 . . . . 0.0 108.468 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.53 ' N ' ' CG ' ' A' ' 48' ' ' PHE . 1.7 mt -47.09 -43.72 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.396 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.9 pp0? -85.77 -10.06 56.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.95 -1.094 . . . . 0.0 110.481 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 47' ' ' HIS . 6.9 mm-40 -86.95 8.15 24.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.96 -1.088 . . . . 0.0 109.771 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.581 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 4.8 p -130.7 55.09 1.85 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.341 -0.849 . . . . 0.0 109.477 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.554 ' C ' ' H ' ' A' ' 55' ' ' ASP . 9.5 p -73.45 159.48 33.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -0.945 . . . . 0.0 109.854 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.17 8.72 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.835 . . . . 0.0 110.156 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.554 ' H ' ' C ' ' A' ' 53' ' ' THR . 44.4 m-20 -116.84 21.8 13.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 109.57 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.524 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.2 OUTLIER -144.7 157.69 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.209 -0.932 . . . . 0.0 109.772 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.664 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -136.23 116.44 13.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.403 -0.81 . . . . 0.0 109.225 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.692 ' C ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -159.68 175.47 13.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.961 -1.087 . . . . 0.0 111.125 -179.357 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.709 ' HB3' HD11 ' A' ' 78' ' ' LEU . 3.5 m-85 -109.84 151.4 27.07 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.899 ' O ' HD12 ' A' ' 78' ' ' LEU . . . -134.37 154.61 51.26 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.896 -1.128 . . . . 0.0 109.349 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.442 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 47.3 t80 -148.8 99.14 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.076 -1.015 . . . . 0.0 108.926 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -118.86 152.66 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.382 -0.824 . . . . 0.0 108.976 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.476 HH11 ' HG3' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -84.47 123.37 30.19 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.403 -0.811 . . . . 0.0 109.053 179.461 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.68 ' HE1' ' OH ' ' A' ' 45' ' ' TYR . 94.1 m-85 -108.14 156.23 19.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.415 -0.803 . . . . 0.0 109.356 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.505 HG22 ' N ' ' A' ' 66' ' ' THR . 98.2 m -78.49 161.01 27.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.153 -0.967 . . . . 0.0 109.12 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.505 ' N ' HG22 ' A' ' 65' ' ' THR . 13.6 t -109.92 159.81 16.93 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.383 -0.823 . . . . 0.0 109.454 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.459 ' O ' ' O ' ' A' ' 66' ' ' THR . . . -51.46 -100.29 0.01 OUTLIER Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -138.1 43.18 2.22 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -1.145 . . . . 0.0 109.453 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -101.25 129.76 47.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.921 . . . . 0.0 109.456 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.434 ' SD ' ' N ' ' A' ' 70' ' ' MET . 2.2 mpt? -71.39 -34.38 70.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.933 . . . . 0.0 109.459 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.5 t -73.03 161.05 31.13 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.206 -0.934 . . . . 0.0 109.439 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' A' ' 73' ' ' ARG . 8.1 mmtp 53.45 51.21 15.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.212 -0.93 . . . . 0.0 109.479 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.492 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.9 tpt180 -43.7 130.75 5.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.252 -0.905 . . . . 0.0 109.417 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 73' ' ' ARG . 0.4 OUTLIER 57.71 154.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.225 -0.922 . . . . 0.0 109.448 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.643 ' HD2' HD22 ' A' ' 129' ' ' LEU . 5.0 mmtm -105.86 143.62 33.75 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.325 -0.859 . . . . 0.0 109.71 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.419 ' O ' ' N ' ' A' ' 109' ' ' ALA . 90.9 m-85 -133.53 117.74 17.48 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.362 -0.836 . . . . 0.0 109.121 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.571 ' HB1' ' O ' ' A' ' 110' ' ' LYS . . . -144.38 167.74 21.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.018 -1.051 . . . . 0.0 111.3 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.899 HD12 ' O ' ' A' ' 60' ' ' ALA . 25.1 tp -114.16 156.48 24.16 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.497 HD11 HD12 ' A' ' 125' ' ' ILE . 6.6 mt -136.23 130.85 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.101 -0.999 . . . . 0.0 108.924 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.542 HG22 HD11 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -95.84 114.58 26.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.186 -0.946 . . . . 0.0 109.84 -179.568 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.673 ' C ' HD13 ' A' ' 82' ' ' ILE . 65.5 t-105 -93.35 112.38 24.28 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.579 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.673 HD13 ' C ' ' A' ' 81' ' ' TRP . 0.9 OUTLIER -114.81 93.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.463 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -48.21 156.39 1.12 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.54 -7.39 38.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -1.14 . . . . 0.0 109.698 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -102.9 21.11 16.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.227 -0.921 . . . . 0.0 109.583 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.878 HG12 ' H ' ' A' ' 87' ' ' SER . 4.8 t -86.28 -141.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.255 -0.903 . . . . 0.0 109.467 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.878 ' H ' HG12 ' A' ' 86' ' ' VAL . 10.0 m -150.27 -146.45 0.2 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.164 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.468 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -83.92 -17.28 65.76 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 90' ' ' GLN . 6.1 mp -46.5 -69.88 0.12 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.178 -1.189 . . . . 0.0 109.802 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.566 ' N ' ' OE1' ' A' ' 90' ' ' GLN . 3.3 mp0 -44.55 -29.65 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.121 -0.987 . . . . 0.0 109.229 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.468 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER -54.37 -64.5 0.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.12 -0.987 . . . . 0.0 109.737 -179.659 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 -44.11 38.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.161 -0.962 . . . . 0.0 109.707 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.35 -65.95 0.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.227 -0.921 . . . . 0.0 110.069 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.406 ' CB ' ' O ' ' A' ' 90' ' ' GLN . 2.1 m -51.86 -54.44 29.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.155 -0.966 . . . . 0.0 109.216 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.41 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.96 -62.84 2.5 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 p -64.58 -50.32 67.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.184 -1.186 . . . . 0.0 111.164 -178.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.435 ' HA ' HD12 ' A' ' 100' ' ' LEU . 2.9 m-20 -66.46 -40.2 89.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.782 -1.199 . . . . 0.0 111.693 -177.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.62 -24.52 65.57 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 120.628 -1.295 . . . . 0.0 109.119 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -77.69 -39.42 44.82 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' A' ' 101' ' ' VAL . 11.6 mt -64.38 -61.46 2.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.404 -0.81 . . . . 0.0 109.044 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.652 HG13 ' NZ ' ' A' ' 7' ' ' LYS . 42.7 t -38.88 -55.83 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 110.262 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 103' ' ' GLU . 76.9 tttt -65.39 -43.56 90.28 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.105 -0.997 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.425 ' C ' ' O ' ' A' ' 102' ' ' LYS . 1.4 tt0 -36.58 -33.64 0.05 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.487 -0.758 . . . . 0.0 111.293 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.755 HG22 ' O ' ' A' ' 104' ' ' VAL . 10.9 p -127.51 34.91 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.107 -0.996 . . . . 0.0 110.839 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.509 ' O ' ' CG1' ' A' ' 105' ' ' VAL . 0.6 OUTLIER -115.07 119.9 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.93 . . . . 0.0 109.018 179.063 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.04 -27.58 1.82 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.248 -0.908 . . . . 0.0 109.388 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -51.89 -34.51 41.57 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.301 -0.874 . . . . 0.0 109.289 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.412 ' CE1' HG13 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -70.12 -176.49 1.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.156 -0.965 . . . . 0.0 109.782 179.941 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -125.01 -29.41 3.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.521 -0.737 . . . . 0.0 109.235 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 0.2 OUTLIER -159.16 140.69 13.19 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.0 109.348 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.655 ' H ' ' CD ' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -105.01 151.12 24.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.27 -0.894 . . . . 0.0 109.14 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -136.03 157.08 47.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.283 -0.886 . . . . 0.0 110.249 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.4 104.37 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.634 HG21 ' HG ' ' A' ' 120' ' ' LEU . 38.5 mm -97.83 151.43 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.184 -0.947 . . . . 0.0 109.816 -179.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.54 5.51 2.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.351 -0.843 . . . . 0.0 109.257 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -135.21 154.58 51.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.578 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -69.52 -42.37 74.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 109.739 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -75.59 -4.18 38.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.153 -0.967 . . . . 0.0 109.294 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.623 ' HB3' HG23 ' A' ' 114' ' ' ILE . 9.9 mm-40 -86.4 0.54 53.84 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.248 -0.907 . . . . 0.0 109.618 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.634 ' HG ' HG21 ' A' ' 114' ' ' ILE . 5.1 mt -104.84 14.58 29.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.278 -0.889 . . . . 0.0 109.041 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -68.71 140.48 55.4 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.496 -0.752 . . . . 0.0 109.675 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.37 -53.02 57.18 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.875 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.78 69.24 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.173 -0.955 . . . . 0.0 109.692 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CE1' ' OE2' ' A' ' 119' ' ' GLU . 78.8 t80 -63.15 -47.71 81.55 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 122.008 0.909 . . . . 0.0 108.977 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.497 HD12 HD11 ' A' ' 79' ' ' ILE . 1.3 mm -74.4 -23.59 18.33 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.58 -55.52 17.2 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.341 -0.85 . . . . 0.0 109.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -23.22 65.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.97 ' HG3' ' HA3' ' A' ' 133' ' ' GLY . 0.3 OUTLIER -85.14 -39.75 17.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.643 HD22 ' HD2' ' A' ' 75' ' ' LYS . 2.8 mt -69.86 -24.1 63.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.27 -0.894 . . . . 0.0 108.923 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -49.57 -35.71 21.45 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.281 -0.887 . . . . 0.0 108.678 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.594 ' HG2' ' N ' ' A' ' 132' ' ' ALA . 10.1 tttm -164.62 -80.79 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.459 -0.776 . . . . 0.0 109.645 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.594 ' N ' ' HG2' ' A' ' 131' ' ' LYS . . . -115.68 -79.61 0.59 Allowed 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.703 -0.623 . . . . 0.0 109.587 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.97 ' HA3' ' HG3' ' A' ' 128' ' ' GLU . . . 107.81 48.22 0.91 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.446 -1.461 . . . . 0.0 109.446 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.426 ' H ' ' H ' ' A' ' 135' ' ' ALA . . . 174.68 0.47 0.03 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.426 ' H ' ' H ' ' A' ' 134' ' ' GLY . . . 53.26 -120.51 1.71 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -1.138 . . . . 0.0 109.405 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 138' ' ' ASP . 2.6 p30 -73.68 -128.39 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.24 -0.913 . . . . 0.0 109.491 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.508 ' N ' ' CG ' ' A' ' 136' ' ' ASN . 12.7 t80 65.34 -41.36 0.32 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.0 109.544 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.586 ' N ' ' O ' ' A' ' 136' ' ' ASN . 8.4 t0 -74.82 -18.28 60.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.169 -0.957 . . . . 0.0 109.487 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -142.5 92.31 2.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.272 -0.893 . . . . 0.0 109.454 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -85.43 61.06 6.62 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.488 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 7.6 t -92.96 5.48 51.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.242 -0.911 . . . . 0.0 109.52 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 117.959 -1.019 . . . . 0.0 109.47 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 3' ' ' THR . . . -79.19 156.53 28.15 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.32 -0.862 . . . . 0.0 109.488 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.567 HG21 ' OD1' ' A' ' 97' ' ' ASP . 0.2 OUTLIER 70.54 144.99 0.06 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.297 -0.877 . . . . 0.0 109.471 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.438 ' HB3' HG23 ' A' ' 35' ' ' THR . 0.3 OUTLIER -133.63 129.34 36.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.391 -0.818 . . . . 0.0 109.452 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.594 ' HB ' HD13 ' A' ' 100' ' ' LEU . 3.3 tp -107.53 135.26 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.835 . . . . 0.0 109.692 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.538 ' O ' ' N ' ' A' ' 8' ' ' GLU . 83.8 m-20 -98.1 49.12 1.0 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.443 ' CE ' ' O ' ' A' ' 104' ' ' VAL . 0.1 OUTLIER -40.44 -24.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.459 -0.776 . . . . 0.0 109.804 -179.409 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -47.49 -39.31 15.68 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.148 -0.97 . . . . 0.0 109.046 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.75 3.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.329 -0.857 . . . . 0.0 109.399 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -52.34 -69.46 0.11 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.124 -0.985 . . . . 0.0 109.536 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.407 ' C ' ' O ' ' A' ' 10' ' ' CYS . 19.2 ttt180 -44.3 -57.64 3.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.858 -1.151 . . . . 0.0 109.378 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.6 -52.77 53.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -19.17 65.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.408 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.65 ' CE2' ' CE1' ' A' ' 61' ' ' PHE . 0.2 OUTLIER -73.72 -56.3 5.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.373 -0.829 . . . . 0.0 109.721 -179.497 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -77.77 -17.88 57.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.332 -0.855 . . . . 0.0 109.918 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.03 -39.27 86.98 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.125 -0.984 . . . . 0.0 109.356 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.525 HG22 ' O ' ' A' ' 14' ' ' TYR . 16.0 m -70.98 -4.57 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.182 -0.949 . . . . 0.0 109.511 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -69.6 5.61 1.37 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.24 -0.912 . . . . 0.0 109.404 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.422 ' H ' ' C ' ' A' ' 17' ' ' VAL . 9.4 t70 -91.65 -146.68 0.21 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.215 -0.928 . . . . 0.0 109.54 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -105.98 44.25 1.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.307 -0.871 . . . . 0.0 109.446 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 69.79 55.58 9.44 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.61 8.09 17.53 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.396 -1.061 . . . . 0.0 109.568 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.2 -128.81 0.14 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.36 -0.838 . . . . 0.0 109.73 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.551 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -105.67 119.09 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.407 -0.808 . . . . 0.0 109.554 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.814 HG22 ' O ' ' A' ' 42' ' ' GLY . 9.9 tt -48.26 -39.79 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.023 -1.048 . . . . 0.0 108.946 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.698 ' CD1' HG23 ' A' ' 25' ' ' ILE . 34.5 p-90 -156.24 150.68 25.67 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.872 -1.143 . . . . 0.0 110.371 178.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -116.05 152.39 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.445 -0.785 . . . . 0.0 109.479 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.545 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 5.9 p -129.76 135.56 48.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.442 -0.786 . . . . 0.0 110.035 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.435 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -124.15 119.15 28.59 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -100.34 147.79 25.41 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.634 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.781 ' OH ' HG23 ' A' ' 94' ' ' THR . 12.3 m-85 -49.49 98.97 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.552 -0.718 . . . . 0.0 110.113 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.71 101.54 13.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.09 -121.0 23.39 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.22 22.09 16.43 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.392 -1.063 . . . . 0.0 110.081 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.438 HG23 ' HB3' ' A' ' 4' ' ' LYS . 24.0 m -142.72 132.36 23.88 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.28 -0.888 . . . . 0.0 110.042 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.463 ' H ' HD12 ' A' ' 36' ' ' ILE . 4.5 mp -79.12 114.98 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.349 -0.844 . . . . 0.0 108.956 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -135.55 151.88 75.33 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.389 -0.819 . . . . 0.0 109.804 -179.322 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.412 ' C ' ' O ' ' A' ' 37' ' ' VAL . 90.3 Cg_exo -34.57 149.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.653 2.236 . . . . 0.0 111.744 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -136.53 -44.35 0.09 OUTLIER Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.979 ' CG ' HE22 ' A' ' 51' ' ' GLN . 0.7 OUTLIER -143.02 -178.86 6.04 Favored 'General case' 0 C--N 1.294 -1.808 0 O-C-N 121.672 -0.899 . . . . 0.0 109.157 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.607 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -144.85 -166.97 2.54 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.441 -0.787 . . . . 0.0 109.789 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.814 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -166.82 134.45 3.28 Favored Glycine 0 N--CA 1.487 2.051 0 N-CA-C 109.654 -1.379 . . . . 0.0 109.654 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.14 -5.55 19.27 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -158.2 176.11 12.91 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.505 ' CE2' ' CE2' ' A' ' 48' ' ' PHE . 1.6 t80 -73.79 -44.74 55.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.012 -1.055 . . . . 0.0 109.55 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 45' ' ' TYR . 9.9 mm100 -42.29 -37.89 1.65 Allowed 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.263 -0.898 . . . . 0.0 110.274 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -60.99 -43.67 98.51 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.061 -1.024 . . . . 0.0 109.781 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.619 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -49.47 -33.99 15.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.133 -0.979 . . . . 0.0 108.707 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.428 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.7 mt -64.36 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.419 -0.8 . . . . 0.0 111.203 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.554 ' NE2' ' O ' ' A' ' 50' ' ' GLN . 2.6 tm0? -85.72 -13.63 47.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.658 -1.276 . . . . 0.0 107.951 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.979 HE22 ' CG ' ' A' ' 40' ' ' ASP . 15.1 mm-40 -96.52 -6.56 36.75 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.583 -178.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.57 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 16.8 p -123.37 54.08 1.29 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.416 -0.803 . . . . 0.0 110.317 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.449 ' C ' ' H ' ' A' ' 55' ' ' ASP . 40.9 p -75.48 155.1 36.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.856 -1.152 . . . . 0.0 109.42 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 p30 -71.77 12.58 0.36 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.768 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.449 ' H ' ' C ' ' A' ' 53' ' ' THR . 13.0 t70 -97.67 -0.19 46.01 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.171 -0.955 . . . . 0.0 110.169 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.514 HG13 ' N ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.41 176.07 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 120.909 -1.119 . . . . 0.0 110.634 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.761 ' NE ' HG11 ' A' ' 86' ' ' VAL . 5.5 ptp180 -138.96 134.75 33.56 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.772 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.5 pp -168.6 172.34 8.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.369 -0.832 . . . . 0.0 109.172 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -105.44 152.73 22.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -0.981 . . . . 0.0 109.282 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -130.17 153.56 48.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.418 -0.801 . . . . 0.0 108.998 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.65 ' CE1' ' CE2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -136.78 107.76 6.7 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.395 -0.815 . . . . 0.0 109.038 -179.583 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.416 ' HB ' ' HB3' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -133.1 143.32 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.393 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -83.12 115.89 22.09 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -93.76 155.72 17.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.232 -0.917 . . . . 0.0 110.171 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.57 149.16 34.88 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.505 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 0.9 OUTLIER -109.63 6.34 23.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 109.547 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 150.77 135.27 2.34 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -79.69 70.56 6.21 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -1.17 . . . . 0.0 109.474 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -150.47 -92.06 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.448 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.535 ' C ' ' H ' ' A' ' 72' ' ' LYS . 2.8 mtt -75.12 -44.15 48.77 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.138 -0.976 . . . . 0.0 109.454 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.456 ' C ' ' H ' ' A' ' 73' ' ' ARG . 1.2 m 54.82 3.9 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.271 -0.893 . . . . 0.0 109.517 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.535 ' H ' ' C ' ' A' ' 70' ' ' MET . 71.0 mttt -73.1 15.7 0.2 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.245 -0.909 . . . . 0.0 109.482 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' CB ' ' A' ' 74' ' ' SER . 30.3 ttt180 -137.62 -62.33 0.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.283 -0.885 . . . . 0.0 109.395 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.51 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 0.5 OUTLIER 76.37 162.5 0.24 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.211 -0.931 . . . . 0.0 109.499 179.879 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HE2' ' HA ' ' A' ' 66' ' ' THR . 8.2 mttm -105.02 150.55 24.86 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.35 -0.844 . . . . 0.0 109.673 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.553 ' O ' ' N ' ' A' ' 109' ' ' ALA . 89.1 m-85 -133.36 117.81 17.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.44 -0.788 . . . . 0.0 109.119 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.71 165.14 28.49 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.973 -1.079 . . . . 0.0 111.456 -178.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 79' ' ' ILE . 11.7 tp -108.89 145.72 34.91 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 114' ' ' ILE . 19.6 mt -131.33 141.44 45.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 120.85 -1.156 . . . . 0.0 108.846 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.0 m -112.62 124.83 53.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.063 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.564 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 60.8 t-105 -96.83 113.34 24.88 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.989 -1.069 . . . . 0.0 109.832 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mm -111.21 93.25 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -74.58 162.79 54.19 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 -179.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -110.46 66.97 0.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.627 -0.926 . . . . 0.0 109.689 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.448 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.2 t0 -169.41 -46.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.218 -0.926 . . . . 0.0 109.552 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.761 HG11 ' NE ' ' A' ' 57' ' ' ARG . 7.4 p -41.62 157.49 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.291 -0.881 . . . . 0.0 109.951 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.459 ' N ' HG22 ' A' ' 86' ' ' VAL . 30.1 p -61.09 173.55 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.414 -0.804 . . . . 0.0 109.971 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.38 -21.49 56.49 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.63 -69.77 0.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.122 -1.222 . . . . 0.0 110.017 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 84.1 mm-40 -49.14 -22.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.81 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 1.7 ttp180 -55.85 -44.13 77.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.808 -1.183 . . . . 0.0 109.436 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.83 -35.66 62.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.234 -0.916 . . . . 0.0 109.894 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.408 ' O ' ' C ' ' A' ' 94' ' ' THR . 10.6 mmmt -74.71 -48.44 25.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -0.919 . . . . 0.0 109.358 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.781 HG23 ' OH ' ' A' ' 31' ' ' TYR . 35.3 m -45.2 -59.5 2.6 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.348 -0.845 . . . . 0.0 109.422 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.73 -59.99 4.03 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 p -63.21 -51.45 66.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.986 -1.302 . . . . 0.0 110.521 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.567 ' OD1' HG21 ' A' ' 3' ' ' THR . 7.4 m-20 -58.45 -45.87 87.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.016 -1.052 . . . . 0.0 110.631 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -51.22 -31.16 19.61 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.847 -1.158 . . . . 0.0 108.24 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.44 -41.18 96.79 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.594 HD13 ' HB ' ' A' ' 5' ' ' ILE . 95.0 mt -48.12 -57.97 5.13 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.536 ' C ' ' H ' ' A' ' 103' ' ' GLU . 4.5 t -56.47 -50.72 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -65.02 7.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.536 ' H ' ' C ' ' A' ' 101' ' ' VAL . 3.0 tt0 -99.77 -44.55 6.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -0.792 . . . . 0.0 109.368 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.781 ' O ' HG12 ' A' ' 104' ' ' VAL . 53.4 t -123.02 62.93 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.439 -0.788 . . . . 0.0 109.863 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.622 HG13 ' O ' ' A' ' 105' ' ' VAL . 4.1 p -132.63 115.22 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.999 -1.063 . . . . 0.0 110.361 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.611 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.9 OUTLIER -125.2 -36.54 2.5 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.181 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.472 ' O ' ' CZ ' ' A' ' 14' ' ' TYR . 0.9 OUTLIER -60.84 32.05 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.928 -0.482 . . . . 0.0 110.245 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.611 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -139.43 139.19 37.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 0.0 109.085 179.475 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -78.84 -35.58 43.78 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.172 -0.955 . . . . 0.0 109.41 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -162.65 157.72 22.24 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.27 -0.894 . . . . 0.0 109.456 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.73 156.45 17.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 108.922 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -139.14 154.92 48.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.136 -0.978 . . . . 0.0 110.104 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.923 ' O ' HD13 ' A' ' 114' ' ' ILE . 6.7 p -119.5 157.76 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.923 HD13 ' O ' ' A' ' 113' ' ' VAL . 2.4 mm -136.33 148.23 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.183 -0.948 . . . . 0.0 109.826 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.53 -3.92 2.97 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.434 ' O ' ' N ' ' A' ' 119' ' ' GLU . 0.1 OUTLIER -157.76 133.61 9.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.298 -0.876 . . . . 0.0 109.51 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.415 ' C ' ' O ' ' A' ' 116' ' ' ASP . 25.4 ttp180 -44.25 -25.37 0.23 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.254 -0.903 . . . . 0.0 109.625 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 116' ' ' ASP . 16.3 tttt -75.82 -18.56 59.43 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.174 -0.954 . . . . 0.0 109.359 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 59.4 mt-10 -86.28 -3.38 58.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.335 -0.853 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.613 HD13 ' CE1' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -105.27 31.41 4.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.176 -0.953 . . . . 0.0 108.866 -179.728 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -83.04 155.1 24.09 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.509 -0.744 . . . . 0.0 109.783 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.15 -50.77 60.05 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.112 -0.993 . . . . 0.0 109.44 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.3 -15.3 9.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.891 . . . . 0.0 109.936 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.608 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 15.0 t80 -84.8 -49.28 8.57 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 0.0 109.184 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.542 ' CG2' HD12 ' A' ' 129' ' ' LEU . 3.0 mt -77.99 -11.88 13.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.802 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.14 -55.86 5.07 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.346 -0.846 . . . . 0.0 108.87 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -17.54 64.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.264 -0.897 . . . . 0.0 109.461 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.439 ' CA ' ' OE1' ' A' ' 128' ' ' GLU . 0.1 OUTLIER -84.74 -40.14 17.64 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.336 -0.852 . . . . 0.0 109.364 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.542 HD12 ' CG2' ' A' ' 125' ' ' ILE . 2.5 mt -79.24 -7.97 58.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.29 -0.881 . . . . 0.0 109.724 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.38 -11.4 46.3 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.05 -1.031 . . . . 0.0 108.942 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.705 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 11.4 mttt -88.77 -64.11 1.19 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.403 -0.811 . . . . 0.0 109.404 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 131' ' ' LYS . . . 76.96 -14.77 0.8 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.405 ' C ' ' O ' ' A' ' 132' ' ' ALA . . . 43.23 39.33 4.03 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 74.67 100.06 0.1 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.42 -52.45 18.47 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.325 -1.103 . . . . 0.0 109.511 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 23.6 p-10 -142.78 13.85 1.91 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.494 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.44 ' O ' ' CD2' ' A' ' 137' ' ' TYR . 50.6 t80 -96.59 39.01 1.17 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.303 -0.873 . . . . 0.0 109.521 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -138.77 3.82 2.29 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.167 -0.958 . . . . 0.0 109.433 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.502 ' O ' ' NE2' ' A' ' 140' ' ' GLN . . . -100.73 -65.49 0.97 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.317 -0.864 . . . . 0.0 109.404 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 139' ' ' ALA . 62.4 mm-40 -139.91 -123.34 0.11 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.199 -0.938 . . . . 0.0 109.425 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.66 86.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 109.491 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 118.005 -0.998 . . . . 0.0 109.462 179.987 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ptt? . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.75 -5.65 51.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.24 -0.912 . . . . 0.0 109.459 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.09 134.69 38.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.229 -0.919 . . . . 0.0 109.477 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB3' HG23 ' A' ' 35' ' ' THR . 4.7 mmtp -136.73 118.61 15.19 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.0 109.427 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.763 ' CD1' HG22 ' A' ' 101' ' ' VAL . 0.9 OUTLIER -107.07 142.29 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.304 -0.873 . . . . 0.0 109.895 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.442 ' O ' ' C ' ' A' ' 7' ' ' LYS . 9.7 m-20 -90.25 44.5 1.2 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.301 -0.874 . . . . 0.0 108.974 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -38.68 -31.13 0.05 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.613 -0.679 . . . . 0.0 110.336 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' A' ' 6' ' ' ASP . 31.4 mt-10 -55.06 -51.22 67.03 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.22 -0.925 . . . . 0.0 110.307 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.96 -69.38 0.18 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.131 -0.981 . . . . 0.0 110.368 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -44.74 -57.89 3.42 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.218 -0.926 . . . . 0.0 110.465 -179.168 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.427 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 19.3 ttt180 -44.99 -58.54 3.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.93 -1.106 . . . . 0.0 110.266 -178.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.06 -46.42 82.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.218 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.402 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -77.39 -10.54 59.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.046 -1.034 . . . . 0.0 110.348 -179.19 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.5 m-85 -81.31 -54.2 5.68 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.427 ' OD1' ' O ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -75.99 -14.41 60.23 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.188 -0.945 . . . . 0.0 109.461 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' A' ' 18' ' ' ARG . 5.2 tt -73.48 -51.48 16.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.379 -0.825 . . . . 0.0 109.474 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.589 ' O ' HG22 ' A' ' 17' ' ' VAL . 3.3 p -55.37 -4.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.206 -0.934 . . . . 0.0 109.524 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -82.57 -13.93 55.72 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.303 -0.873 . . . . 0.0 109.453 -179.819 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.487 ' O ' ' O ' ' A' ' 18' ' ' ARG . 4.3 p-10 -58.23 -151.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.33 -0.856 . . . . 0.0 109.649 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.92 43.98 1.1 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.232 -0.917 . . . . 0.0 109.314 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.41 56.97 5.81 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.661 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 2.8 t -76.41 -42.18 45.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.22 -1.165 . . . . 0.0 109.384 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 166.96 -168.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.269 -0.894 . . . . 0.0 109.463 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.796 ' O ' HG12 ' A' ' 24' ' ' VAL . 75.7 t 47.24 52.28 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.162 -0.961 . . . . 0.0 109.365 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.906 HG23 ' CD1' ' A' ' 26' ' ' TRP . 12.8 tt -46.26 -29.78 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 120.824 -1.172 . . . . 0.0 108.575 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.906 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.2 p-90 -156.17 150.94 26.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.879 -1.138 . . . . 0.0 110.076 177.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -113.24 144.84 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.535 -0.728 . . . . 0.0 109.797 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 59' ' ' PHE . 18.4 p -138.11 132.73 32.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.42 -0.8 . . . . 0.0 109.77 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.24 145.15 47.31 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.46 ' O ' ' N ' ' A' ' 32' ' ' ASP . 24.7 ptt180 -119.49 141.29 49.31 Favored 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 119.765 -0.774 . . . . 0.0 109.95 -178.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.45 ' CD1' ' NE2' ' A' ' 90' ' ' GLN . 0.6 OUTLIER -41.28 98.44 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.718 -0.614 . . . . 0.0 109.783 -179.422 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -91.47 101.99 14.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.884 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 54.11 -116.51 6.31 Favored Glycine 0 N--CA 1.487 2.087 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.52 25.3 11.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.391 -1.064 . . . . 0.0 110.211 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.409 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.7 m -146.31 133.91 20.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.193 -0.942 . . . . 0.0 109.816 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.1 mp -81.72 111.98 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.031 -1.043 . . . . 0.0 108.73 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.45 152.49 76.6 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.347 -0.846 . . . . 0.0 109.977 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -39.16 140.44 0.48 Allowed 'Trans proline' 0 C--N 1.311 -1.409 0 C-N-CA 122.659 2.239 . . . . 0.0 112.249 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.18 -33.49 0.36 Allowed Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.535 ' CB ' HE22 ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.12 -177.93 5.59 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.619 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -138.44 -176.94 4.64 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-O 121.821 0.82 . . . . 0.0 110.387 -179.826 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.633 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -119.66 83.71 0.36 Allowed Glycine 0 N--CA 1.479 1.556 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.607 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -104.71 56.38 0.7 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.643 -0.916 . . . . 0.0 108.53 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.607 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 33.5 t0 120.21 140.84 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -179.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -56.86 -47.36 80.6 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.067 -1.021 . . . . 0.0 108.462 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -53.27 -34.87 59.05 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.345 -0.847 . . . . 0.0 109.416 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -53.21 -28.95 29.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.0 108.896 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.597 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.24 -34.98 75.66 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.938 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.43 HG12 ' CE2' ' A' ' 48' ' ' PHE . 4.5 mt -76.29 -13.97 14.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.222 -0.924 . . . . 0.0 109.553 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -87.67 -50.41 6.51 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.105 -0.997 . . . . 0.0 109.411 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.535 HE22 ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -108.07 55.97 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.64 -0.662 . . . . 0.0 111.145 -178.183 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.1 t -162.32 62.66 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.082 -1.011 . . . . 0.0 109.184 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.583 ' O ' ' N ' ' A' ' 55' ' ' ASP . 2.5 p -87.54 154.68 20.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.404 -0.81 . . . . 0.0 109.916 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -46.14 -11.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.856 . . . . 0.0 109.652 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 53' ' ' THR . 1.9 t70 -93.27 35.37 1.09 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.202 -0.936 . . . . 0.0 109.403 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.581 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 53.3 t -145.4 145.3 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.282 -0.886 . . . . 0.0 109.45 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.654 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.51 122.98 27.08 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.48 -0.762 . . . . 0.0 109.68 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.606 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.84 -170.93 0.71 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.934 -1.104 . . . . 0.0 110.718 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.623 ' N ' ' CD1' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -118.32 153.61 33.69 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.213 -0.929 . . . . 0.0 109.145 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -136.31 156.35 48.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.791 -1.193 . . . . 0.0 109.309 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -149.56 103.35 3.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.16 -0.962 . . . . 0.0 109.375 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -118.37 154.37 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.241 -0.912 . . . . 0.0 109.602 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.582 ' NH2' ' O ' ' A' ' 17' ' ' VAL . 14.4 ttp180 -84.61 130.73 34.69 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -118.26 157.1 27.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.439 -0.788 . . . . 0.0 109.83 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.58 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . 8.7 t -97.0 140.96 30.75 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.314 -0.866 . . . . 0.0 109.044 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.58 ' O ' ' N ' ' A' ' 68' ' ' ASP . 0.2 OUTLIER -109.64 110.84 22.01 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.4 -0.813 . . . . 0.0 109.614 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.436 ' O ' ' CG ' ' A' ' 68' ' ' ASP . . . 57.28 -78.92 0.01 OUTLIER Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.58 ' N ' ' O ' ' A' ' 66' ' ' THR . 1.0 OUTLIER 176.72 -37.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.262 -1.14 . . . . 0.0 109.333 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.61 ' CB ' ' HB2' ' A' ' 73' ' ' ARG . . . 62.45 -174.9 0.14 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.273 -0.892 . . . . 0.0 109.486 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.79 ' O ' ' SD ' ' A' ' 70' ' ' MET . 1.8 tmm? -88.8 -28.05 20.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.867 . . . . 0.0 109.427 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.427 ' OG ' ' CE ' ' A' ' 70' ' ' MET . 19.9 m -135.23 -59.29 0.78 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.303 -0.873 . . . . 0.0 109.553 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.483 ' O ' ' CB ' ' A' ' 73' ' ' ARG . 16.4 mmtp -138.89 -93.58 0.18 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.229 -0.919 . . . . 0.0 109.528 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.61 ' HB2' ' CB ' ' A' ' 69' ' ' ALA . 0.1 OUTLIER 74.15 12.88 4.08 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.303 -0.873 . . . . 0.0 109.421 -179.911 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.419 ' C ' ' O ' ' A' ' 73' ' ' ARG . 25.0 p -42.56 151.2 0.12 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.271 -0.893 . . . . 0.0 109.459 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.58 ' NZ ' ' O ' ' A' ' 65' ' ' THR . 4.2 pttm -107.32 130.93 54.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.364 -0.835 . . . . 0.0 109.215 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.518 ' O ' ' N ' ' A' ' 109' ' ' ALA . 98.9 m-85 -103.82 129.3 51.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 110.275 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.57 161.95 37.82 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.126 -0.984 . . . . 0.0 111.241 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.8 157.44 25.56 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.9 mt -137.55 143.38 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 120.843 -1.161 . . . . 0.0 109.309 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.596 ' N ' ' O ' ' A' ' 112' ' ' PHE . 0.2 OUTLIER -100.82 114.83 28.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.162 -0.961 . . . . 0.0 109.03 179.636 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.597 ' CH2' ' O ' ' A' ' 115' ' ' SER . 73.5 t-105 -92.81 110.49 21.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.142 -0.973 . . . . 0.0 109.785 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.463 ' O ' ' OG ' ' A' ' 115' ' ' SER . 8.1 mm -114.88 92.5 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.03 161.09 0.05 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -88.36 -20.27 25.55 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -1.109 . . . . 0.0 109.457 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.49 41.46 1.23 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 109.505 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.514 HG12 ' N ' ' A' ' 87' ' ' SER . 52.0 t -96.83 161.98 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.228 -0.92 . . . . 0.0 109.732 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.514 ' N ' HG12 ' A' ' 86' ' ' VAL . 7.9 t -95.32 -162.47 0.95 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.253 -0.904 . . . . 0.0 109.42 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.06 -18.12 63.69 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.5 mt -46.69 -60.86 2.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.912 -1.346 . . . . 0.0 109.79 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.45 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 22.3 mm-40 -56.8 -30.76 64.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.006 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -50.93 -62.32 1.68 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.924 -1.11 . . . . 0.0 109.916 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.99 -44.04 15.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.161 -0.962 . . . . 0.0 110.014 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.401 ' O ' ' OH ' ' A' ' 31' ' ' TYR . 21.3 mtpt -58.43 -58.93 6.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.207 -0.933 . . . . 0.0 110.007 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.442 ' OG1' ' CD ' ' A' ' 90' ' ' GLN . 2.1 m -57.19 -40.82 78.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.111 -0.993 . . . . 0.0 109.487 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -43.72 -59.61 3.67 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.164 -1.175 . . . . 0.0 110.164 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.9 p -63.8 -42.88 97.63 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.072 -1.252 . . . . 0.0 110.845 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.0 -44.18 90.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.852 -1.155 . . . . 0.0 111.192 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -26.56 45.88 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.683 -1.261 . . . . 0.0 108.899 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -50.78 48.67 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.431 -0.793 . . . . 0.0 109.275 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.577 ' N ' HD12 ' A' ' 100' ' ' LEU . 8.5 mp -57.3 -59.49 5.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.763 HG22 ' CD1' ' A' ' 5' ' ' ILE . 21.8 t -44.46 -69.18 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.847 . . . . 0.0 109.409 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 ttpp -48.61 -47.79 39.74 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.466 -0.771 . . . . 0.0 110.046 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.86 -31.55 71.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 111.013 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.7 p -106.28 13.71 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.096 -1.003 . . . . 0.0 110.747 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.493 ' O ' ' CG1' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -108.39 124.43 64.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.102 -0.999 . . . . 0.0 109.829 179.81 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.648 ' C ' ' H ' ' A' ' 108' ' ' PHE . 5.7 mp0 -126.51 -30.21 2.86 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -62.39 29.27 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.537 -0.727 . . . . 0.0 109.93 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.648 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -141.95 160.85 39.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.153 -0.967 . . . . 0.0 109.238 179.502 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -95.66 -37.97 10.58 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.824 . . . . 0.0 109.609 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -158.29 159.83 36.38 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 109.438 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.75 160.48 14.94 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 109.172 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.596 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.9 m-85 -138.54 149.71 45.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.286 -0.884 . . . . 0.0 109.875 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.403 ' HA ' ' HG1' ' A' ' 80' ' ' THR . 58.6 t -114.67 118.73 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.525 -0.734 . . . . 0.0 109.036 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.497 HG23 ' OE2' ' A' ' 119' ' ' GLU . 7.2 mt -138.55 158.62 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.0 110.289 -179.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.597 ' O ' ' CH2' ' A' ' 81' ' ' TRP . 11.2 t -134.1 -46.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.95 155.57 23.95 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.59 -0.694 . . . . 0.0 109.619 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -79.62 -17.82 52.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.107 -0.995 . . . . 0.0 109.841 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 60.4 tttt -73.51 -33.47 64.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.003 . . . . 0.0 109.832 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.588 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 0.3 OUTLIER -86.34 5.02 36.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.062 -1.024 . . . . 0.0 109.853 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.471 HD22 ' CE1' ' A' ' 48' ' ' PHE . 4.0 tt -104.26 0.45 29.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.166 -0.959 . . . . 0.0 109.188 179.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -49.5 139.36 12.22 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.428 -0.795 . . . . 0.0 109.798 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.542 ' H ' ' CD ' ' A' ' 122' ' ' GLU . 0.1 OUTLIER -52.08 -53.81 37.89 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 109.878 -179.871 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ASP . . . . . 0.401 ' OD1' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.01 -48.81 72.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.096 -1.002 . . . . 0.0 109.825 -179.265 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 65.9 t80 -48.48 -42.69 33.53 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 122.203 1.001 . . . . 0.0 109.073 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -76.11 -24.28 16.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.908 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.7 ttp180 -65.1 -55.71 17.18 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.238 -0.914 . . . . 0.0 109.107 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.0 t -62.52 -21.4 65.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -76.55 -41.74 45.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.436 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.579 ' C ' ' H ' ' A' ' 131' ' ' LYS . 16.3 mt -69.14 -38.7 78.96 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.154 -0.966 . . . . 0.0 108.56 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -54.33 -4.78 0.06 Allowed 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.153 -0.967 . . . . 0.0 108.567 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.579 ' H ' ' C ' ' A' ' 129' ' ' LEU . 6.9 tttp 60.9 102.25 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 CA-C-O 121.725 0.774 . . . . 0.0 109.421 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -149.51 41.62 0.88 Allowed 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 119.722 -0.791 . . . . 0.0 109.57 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.46 -36.94 8.39 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -100.53 121.99 7.43 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -147.75 67.52 1.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -1.121 . . . . 0.0 109.45 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.495 ' N ' ' OD1' ' A' ' 136' ' ' ASN . 0.0 OUTLIER -75.92 -49.0 19.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.297 -0.877 . . . . 0.0 109.461 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.497 ' CG ' ' O ' ' A' ' 137' ' ' TYR . 66.5 t80 52.07 23.72 2.38 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.332 -0.855 . . . . 0.0 109.474 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.522 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -167.54 -61.33 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.287 -0.883 . . . . 0.0 109.509 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.522 ' HB2' ' O ' ' A' ' 138' ' ' ASP . . . 174.28 122.66 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.278 -0.889 . . . . 0.0 109.48 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.452 ' O ' ' O ' ' A' ' 141' ' ' SER . 0.1 OUTLIER -84.39 118.84 24.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.254 -0.904 . . . . 0.0 109.521 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 142' ' ' GLU . 1.2 t 49.91 179.57 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.258 -0.901 . . . . 0.0 109.469 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.514 ' N ' ' OG ' ' A' ' 141' ' ' SER . 4.4 tt0 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.994 -1.003 . . . . 0.0 109.507 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.516 ' C ' ' H ' ' A' ' 3' ' ' THR . 9.1 mtm . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 52.85 6.01 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.286 -0.884 . . . . 0.0 109.452 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.516 ' H ' ' C ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -90.37 126.75 35.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.27 -0.894 . . . . 0.0 109.458 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.451 ' CB ' HG23 ' A' ' 35' ' ' THR . 3.7 mtpt -130.18 135.95 48.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.394 -0.816 . . . . 0.0 109.48 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.522 ' HB ' HD13 ' A' ' 100' ' ' LEU . 3.9 tp -118.46 130.28 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.47 -0.769 . . . . 0.0 109.335 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.504 ' O ' ' N ' ' A' ' 8' ' ' GLU . 5.6 m-20 -91.73 39.68 1.02 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.118 -0.989 . . . . 0.0 109.051 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.694 ' NZ ' ' H ' ' A' ' 104' ' ' VAL . 3.5 mttt -42.43 -23.34 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.813 -179.509 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.52 ' H ' ' CD ' ' A' ' 8' ' ' GLU . 39.3 mp0 -50.11 -35.46 25.69 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.093 -1.005 . . . . 0.0 108.364 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.42 -46.02 13.01 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.57 ' O ' ' N ' ' A' ' 14' ' ' TYR . 13.0 t -60.67 -66.17 0.57 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.242 -0.911 . . . . 0.0 109.489 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.484 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 32.0 ttp180 -44.19 -56.24 4.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.756 -1.215 . . . . 0.0 109.882 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.13 -28.07 67.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.01 -1.056 . . . . 0.0 109.762 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.458 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -88.5 -58.22 2.63 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.073 -1.017 . . . . 0.0 109.605 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.661 ' CD1' ' CD1' ' A' ' 61' ' ' PHE . 5.9 t80 -45.16 -51.18 10.76 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.301 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.536 ' N ' ' ND2' ' A' ' 15' ' ' ASN . 0.3 OUTLIER -71.22 -45.04 64.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.023 -1.048 . . . . 0.0 110.248 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.522 ' C ' ' H ' ' A' ' 18' ' ' ARG . 20.6 tp -41.54 -48.64 3.98 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.076 -1.015 . . . . 0.0 110.063 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 14' ' ' TYR . 1.2 m -53.85 -4.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.062 -1.024 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.522 ' H ' ' C ' ' A' ' 16' ' ' LEU . 6.8 ttm180 -76.63 -17.13 59.34 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.149 -0.97 . . . . 0.0 109.285 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.486 ' O ' ' O ' ' A' ' 18' ' ' ARG . 22.2 t0 -58.0 -151.61 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.255 -0.903 . . . . 0.0 109.627 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.441 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 12.9 t70 -102.47 59.41 0.81 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.219 -0.926 . . . . 0.0 109.471 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 67.44 50.86 40.99 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.749 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.6 OUTLIER -72.54 -39.76 67.25 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.274 -1.133 . . . . 0.0 109.592 -179.805 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.749 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 158.15 -164.4 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.591 -0.693 . . . . 0.0 109.559 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.721 ' O ' HG22 ' A' ' 24' ' ' VAL . 4.6 p 35.39 57.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.676 -0.64 . . . . 0.0 110.458 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.813 HG22 ' O ' ' A' ' 42' ' ' GLY . 6.9 tt -42.92 -41.63 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.173 -0.954 . . . . 0.0 109.267 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.663 ' CD1' HG23 ' A' ' 25' ' ' ILE . 43.2 p-90 -149.25 166.78 27.89 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 120.992 -1.067 . . . . 0.0 110.261 178.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.453 HG13 ' CG2' ' A' ' 24' ' ' VAL . 18.3 m -137.68 141.81 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.891 . . . . 0.0 109.329 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.596 HG23 ' CE3' ' A' ' 26' ' ' TRP . 66.5 p -129.17 140.19 51.61 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 109.877 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.99 125.27 44.93 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -100.08 148.39 24.61 Favored 'General case' 0 C--N 1.296 -1.722 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.334 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.925 ' OH ' HG23 ' A' ' 94' ' ' THR . 23.0 m-85 -57.87 98.7 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.558 -0.714 . . . . 0.0 109.779 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.61 102.07 13.47 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.28 -126.14 9.18 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.95 17.9 21.26 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.41 -1.053 . . . . 0.0 110.041 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.451 HG23 ' CB ' ' A' ' 4' ' ' LYS . 1.8 m -138.23 136.4 36.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.244 -0.91 . . . . 0.0 110.042 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.521 ' CD1' ' OD1' ' A' ' 97' ' ' ASP . 4.3 mp -79.78 115.36 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.38 150.83 73.56 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 109.937 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -34.56 152.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.376 0 C-N-CA 122.89 2.393 . . . . 0.0 112.324 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.29 -53.25 0.07 OUTLIER Glycine 0 N--CA 1.489 2.207 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.639 ' OD2' ' NE2' ' A' ' 51' ' ' GLN . 14.1 t70 -143.28 179.53 7.03 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.713 -0.875 . . . . 0.0 108.976 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.589 ' H ' ' CD ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -140.98 -165.98 2.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 110.057 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.813 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.06 131.65 2.5 Favored Glycine 0 N--CA 1.486 1.969 0 N-CA-C 109.864 -1.295 . . . . 0.0 109.864 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.83 -5.06 21.51 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -148.3 164.84 32.81 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.465 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.56 ' C ' ' CD1' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -78.48 -11.4 59.95 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.033 -1.042 . . . . 0.0 109.585 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.54 -31.23 63.55 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.057 -1.027 . . . . 0.0 109.759 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.448 ' O ' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.47 -51.84 32.3 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.978 -1.076 . . . . 0.0 109.751 -179.666 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.687 ' CE1' HD22 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -43.25 -36.75 1.9 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.548 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.425 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mm -63.65 -41.31 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.339 -0.85 . . . . 0.0 110.455 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 50' ' ' GLN . 1.6 tm0? -87.06 -15.74 37.67 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.639 ' NE2' ' OD2' ' A' ' 40' ' ' ASP . 14.6 mm-40 -99.25 61.47 1.22 Allowed 'General case' 0 C--N 1.3 -1.579 0 CA-C-O 122.261 1.029 . . . . 0.0 109.925 -179.089 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 14.3 p -179.86 56.63 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.27 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.555 ' O ' ' NE1' ' A' ' 81' ' ' TRP . 3.1 p -77.87 156.01 30.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.058 -1.026 . . . . 0.0 110.025 -179.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.13 12.35 0.57 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.815 . . . . 0.0 109.847 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 53' ' ' THR . 20.9 m-20 -97.89 1.21 47.85 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.199 -0.938 . . . . 0.0 109.74 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.567 HG13 ' N ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.34 -179.65 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.043 -1.036 . . . . 0.0 110.293 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.802 ' CZ ' HG11 ' A' ' 86' ' ' VAL . 5.2 ptp180 -140.17 138.64 35.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.32 -0.862 . . . . 0.0 110.024 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.746 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.7 pp -172.22 169.09 5.54 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.418 -0.802 . . . . 0.0 109.409 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.529 ' O ' HG22 ' A' ' 28' ' ' THR . 3.8 m-85 -101.02 153.02 19.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.028 -1.045 . . . . 0.0 109.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.737 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -123.94 152.31 42.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.302 -0.874 . . . . 0.0 109.045 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.661 ' CD1' ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -140.47 96.34 3.02 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.413 -0.805 . . . . 0.0 109.087 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.5 ' O ' ' CE2' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -133.99 129.87 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 120.735 -1.228 . . . . 0.0 109.869 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.653 ' HE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ptm180 -68.16 142.86 55.6 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.175 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.5 ' CE2' ' O ' ' A' ' 62' ' ' VAL . 97.9 m-85 -118.79 155.92 30.3 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.796 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 m -81.75 131.43 35.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.157 -0.965 . . . . 0.0 109.037 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.88 78.62 1.14 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.353 -0.842 . . . . 0.0 109.484 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 92.29 94.5 1.4 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.8 90.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -1.132 . . . . 0.0 109.492 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.558 ' O ' ' N ' ' A' ' 71' ' ' SER . . . -138.02 146.28 42.88 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.3 -0.875 . . . . 0.0 109.46 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 32.1 mtt -65.89 43.1 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.255 -0.903 . . . . 0.0 109.473 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.558 ' N ' ' O ' ' A' ' 69' ' ' ALA . 0.6 OUTLIER -102.49 -11.18 18.74 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.256 -0.902 . . . . 0.0 109.396 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' A' ' 71' ' ' SER . 27.6 mttt 43.21 53.0 5.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.239 -0.913 . . . . 0.0 109.493 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.489 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.6 tpp180 -107.21 -50.06 3.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.352 -0.843 . . . . 0.0 109.513 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.653 ' CB ' ' HE ' ' A' ' 63' ' ' ARG . 21.0 p 58.76 148.55 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.366 -0.834 . . . . 0.0 109.669 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.688 ' NZ ' ' HB3' ' A' ' 109' ' ' ALA . 3.7 ttpt -104.59 170.2 8.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.443 -0.786 . . . . 0.0 109.08 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 109' ' ' ALA . 79.1 m-85 -134.06 126.78 30.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.126 -0.984 . . . . 0.0 111.289 -178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.508 ' HB2' ' NZ ' ' A' ' 75' ' ' LYS . . . -144.79 166.6 24.79 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.518 -0.739 . . . . 0.0 110.439 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.549 HD12 ' CE2' ' A' ' 61' ' ' PHE . 2.1 tt -113.85 151.43 32.14 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.737 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 7.6 mt -128.22 131.93 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 120.949 -1.094 . . . . 0.0 109.563 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.5 m -100.98 124.61 46.96 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.348 -0.845 . . . . 0.0 109.831 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.555 ' NE1' ' O ' ' A' ' 53' ' ' THR . 58.0 t-105 -102.45 111.96 24.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.175 -0.953 . . . . 0.0 109.831 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mm -109.86 93.35 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.26 153.95 48.03 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -104.63 56.26 0.71 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.63 -0.923 . . . . 0.0 109.612 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 86' ' ' VAL . 7.9 t70 -158.59 -39.02 0.06 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.217 -0.927 . . . . 0.0 109.528 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.802 HG11 ' CZ ' ' A' ' 57' ' ' ARG . 12.6 p -40.87 156.97 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.981 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.414 ' N ' HG22 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -66.95 -176.1 0.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.312 -0.868 . . . . 0.0 109.54 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.459 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.35 -22.76 53.46 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -46.68 -70.03 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.153 -1.204 . . . . 0.0 110.074 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.4 ' CB ' HH11 ' A' ' 57' ' ' ARG . 58.3 mt-30 -48.06 -21.71 0.5 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 109.82 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.459 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 5.7 ttt180 -58.66 -45.26 89.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.966 -1.084 . . . . 0.0 109.578 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.48 -37.4 56.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.247 -0.908 . . . . 0.0 109.793 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 94' ' ' THR . 4.4 mttm -73.71 -52.94 11.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.154 -0.966 . . . . 0.0 109.539 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.925 HG23 ' OH ' ' A' ' 31' ' ' TYR . 59.6 m -45.34 -56.02 5.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -44.38 -60.2 3.76 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -63.79 -50.73 67.83 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.974 -1.309 . . . . 0.0 110.223 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.521 ' OD1' ' CD1' ' A' ' 36' ' ' ILE . 3.4 t70 -57.14 -47.05 82.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.989 -1.069 . . . . 0.0 110.283 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 97' ' ' ASP . 6.1 ptmt -47.62 -33.32 6.52 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.839 -1.145 . . . . 0.0 107.984 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.7 m -59.87 -40.33 88.29 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.522 HD13 ' HB ' ' A' ' 5' ' ' ILE . 95.6 mt -49.75 -60.4 2.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.537 ' C ' ' H ' ' A' ' 103' ' ' GLU . 21.6 t -53.36 -46.62 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -65.44 7.85 0.19 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.537 ' H ' ' C ' ' A' ' 101' ' ' VAL . 19.8 tt0 -100.05 -44.58 5.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.427 -0.796 . . . . 0.0 110.325 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.784 ' O ' HG12 ' A' ' 104' ' ' VAL . 77.2 t -126.01 60.05 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.233 -0.917 . . . . 0.0 110.839 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.578 ' O ' HG12 ' A' ' 105' ' ' VAL . 4.2 t -130.52 96.94 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.075 -1.016 . . . . 0.0 109.56 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.585 ' C ' ' H ' ' A' ' 108' ' ' PHE . 35.0 mt-30 -120.2 -35.67 3.4 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.444 ' CG ' ' O ' ' A' ' 107' ' ' ASN . 36.6 t30 -62.53 35.45 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.7 -0.625 . . . . 0.0 110.298 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.585 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -139.14 150.69 45.93 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.164 -0.96 . . . . 0.0 108.983 178.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.688 ' HB3' ' NZ ' ' A' ' 75' ' ' LYS . . . -79.48 -44.27 21.6 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.331 -0.856 . . . . 0.0 109.502 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -160.87 159.51 29.87 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.143 -0.973 . . . . 0.0 109.481 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.62 157.41 17.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.25 -0.906 . . . . 0.0 109.164 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -117.75 142.35 47.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.643 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.8 t -110.6 97.03 5.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.448 HG22 ' H ' ' A' ' 116' ' ' ASP . 10.3 mm -103.47 152.32 6.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 O-C-N 121.3 -0.875 . . . . 0.0 110.828 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.5 p -139.77 5.37 2.17 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.448 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -160.46 155.39 24.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.386 -0.821 . . . . 0.0 109.271 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 20.7 mtm180 -67.08 -24.12 65.93 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 0.0 109.769 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -69.33 -23.03 63.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.0 109.216 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.421 ' CB ' HG23 ' A' ' 114' ' ' ILE . 30.0 mt-10 -86.56 -1.89 58.02 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.389 -0.819 . . . . 0.0 109.648 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.687 HD22 ' CE1' ' A' ' 48' ' ' PHE . 2.9 mt -107.08 25.54 11.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.257 -0.902 . . . . 0.0 109.429 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -82.98 146.32 28.85 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.403 -0.811 . . . . 0.0 109.646 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 1.001 ' HB2' ' NH2' ' A' ' 126' ' ' ARG . 0.2 OUTLIER -52.56 -55.32 23.04 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.132 -0.98 . . . . 0.0 109.338 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.11 -19.66 14.14 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.306 -0.872 . . . . 0.0 110.232 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.501 ' C ' ' CD1' ' A' ' 124' ' ' PHE . 16.5 t80 -86.86 -49.14 7.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.215 -0.928 . . . . 0.0 109.074 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.3 mm -75.96 -25.7 17.2 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.788 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 1.001 ' NH2' ' HB2' ' A' ' 122' ' ' GLU . 1.8 ttm-85 -73.04 -54.64 8.05 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.159 -0.963 . . . . 0.0 109.007 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.8 t -63.81 -12.39 35.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.412 -0.805 . . . . 0.0 109.578 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -84.82 -38.11 19.93 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.19 -0.944 . . . . 0.0 109.601 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.615 HD22 ' NZ ' ' A' ' 75' ' ' LYS . 92.2 mt -72.57 -39.99 66.98 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.946 . . . . 0.0 109.315 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.991 ' HZ2' ' HA ' ' A' ' 130' ' ' LYS . 0.0 OUTLIER -62.4 -15.75 50.75 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.094 -1.004 . . . . 0.0 109.512 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.573 ' O ' ' N ' ' A' ' 133' ' ' GLY . 0.1 OUTLIER -75.29 -69.81 0.46 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.318 -0.864 . . . . 0.0 109.498 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -60.32 74.76 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.282 -0.886 . . . . 0.0 109.485 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 131' ' ' LYS . . . -90.22 136.53 13.5 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 60.77 -173.37 5.92 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -172.59 -38.75 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.279 -1.13 . . . . 0.0 109.443 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.464 ' O ' ' O ' ' A' ' 140' ' ' GLN . 9.8 p-10 -73.51 8.87 1.58 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.361 -0.837 . . . . 0.0 109.548 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -92.05 -31.66 15.48 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.192 -0.942 . . . . 0.0 109.439 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.07 -29.72 62.02 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.26 -0.9 . . . . 0.0 109.507 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -95.34 -123.72 0.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.354 -0.841 . . . . 0.0 109.497 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.464 ' O ' ' O ' ' A' ' 136' ' ' ASN . 68.7 mm-40 -78.56 161.93 26.66 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.936 . . . . 0.0 109.426 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 14.1 p -87.58 52.27 2.44 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.266 -0.896 . . . . 0.0 109.531 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 118.028 -0.987 . . . . 0.0 109.464 179.997 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.2 mtt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.283 0.563 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.29 9.37 0.42 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.319 -0.863 . . . . 0.0 109.446 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.617 HG21 ' OD1' ' A' ' 97' ' ' ASP . 0.5 OUTLIER -139.45 147.83 41.9 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.317 -0.864 . . . . 0.0 109.48 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -134.06 118.27 17.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.385 -0.822 . . . . 0.0 109.176 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.89 140.41 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.869 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 2.6 t70 -97.07 45.48 1.04 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 108.959 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.446 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -40.46 -21.58 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.432 -0.793 . . . . 0.0 109.724 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.7 tt0 -52.88 -42.17 65.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.241 -0.912 . . . . 0.0 109.28 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.57 -67.04 0.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.192 -0.942 . . . . 0.0 109.419 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.646 ' SG ' ' CE2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -44.69 -60.59 1.93 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.206 -0.934 . . . . 0.0 109.701 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.534 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 11.3 ttp180 -44.22 -58.54 2.82 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.927 -1.108 . . . . 0.0 109.778 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.68 -28.94 16.27 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.062 -1.024 . . . . 0.0 109.229 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.946 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -87.69 -50.92 6.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.198 -0.938 . . . . 0.0 109.776 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.481 ' OH ' HD12 ' A' ' 78' ' ' LEU . 6.1 m-85 -45.74 -56.17 5.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.941 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.534 ' ND2' ' O ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -64.25 -40.1 95.31 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.11 -0.994 . . . . 0.0 109.411 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.6 -25.5 66.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.884 . . . . 0.0 109.275 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.946 HG23 ' O ' ' A' ' 13' ' ' ALA . 29.6 t -80.88 -13.9 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.245 -0.909 . . . . 0.0 109.377 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.481 ' O ' ' O ' ' A' ' 19' ' ' ASP . 56.5 mtm180 -73.13 -17.85 61.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.241 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.584 ' OD2' ' N ' ' A' ' 22' ' ' SER . 54.1 p-10 -59.44 -145.7 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.298 -0.876 . . . . 0.0 109.487 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.12 4.81 34.56 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.313 -0.867 . . . . 0.0 108.854 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.543 ' H ' ' CG ' ' A' ' 19' ' ' ASP . . . 127.05 67.07 0.15 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.728 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -65.1 -32.14 73.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.158 -1.201 . . . . 0.0 109.633 -179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.728 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 158.92 -77.49 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.498 -0.751 . . . . 0.0 110.191 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.793 HG23 ' O ' ' A' ' 24' ' ' VAL . 12.4 m -59.35 70.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.31 -0.869 . . . . 0.0 110.449 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.806 HG23 ' CD1' ' A' ' 26' ' ' TRP . 2.2 tt -45.69 -41.73 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.923 -1.11 . . . . 0.0 108.366 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.806 ' CD1' HG23 ' A' ' 25' ' ' ILE . 33.2 p-90 -142.95 136.97 29.07 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.714 -1.241 . . . . 0.0 109.776 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -115.24 144.87 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.42 -0.8 . . . . 0.0 110.107 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.598 ' HB ' HD13 ' A' ' 58' ' ' LEU . 6.4 p -133.71 144.02 48.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.429 -0.795 . . . . 0.0 110.972 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.646 ' CE2' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -129.42 130.05 45.47 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 179.297 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -107.7 149.43 28.15 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.465 -0.772 . . . . 0.0 109.597 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.405 ' OH ' HG23 ' A' ' 94' ' ' THR . 6.0 m-85 -49.02 98.73 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.455 -0.778 . . . . 0.0 109.912 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.64 101.61 13.48 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.94 -119.07 16.59 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.08 22.83 15.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.394 -1.062 . . . . 0.0 110.015 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 m -145.7 129.35 17.1 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.19 -0.944 . . . . 0.0 109.765 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.747 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.6 mp -78.54 113.84 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 108.947 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.424 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -135.58 153.7 77.77 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.285 -0.884 . . . . 0.0 109.822 -179.304 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.424 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.9 Cg_exo -32.02 145.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.357 0 C-N-CA 122.989 2.46 . . . . 0.0 112.26 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -139.1 -33.38 0.17 Allowed Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.542 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -143.28 -179.0 6.13 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 121.715 -0.873 . . . . 0.0 109.276 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.506 HE22 ' CD2' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -153.17 -171.53 3.95 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.797 0.808 . . . . 0.0 110.838 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.68 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -166.71 128.2 1.71 Allowed Glycine 0 N--CA 1.483 1.822 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.08 -10.04 17.43 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -155.35 172.05 18.85 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.467 ' OH ' ' O ' ' A' ' 120' ' ' LEU . 9.4 t80 -70.22 -45.83 65.75 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 120.895 -1.128 . . . . 0.0 109.332 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.458 ' N ' ' CD ' ' A' ' 46' ' ' GLN . 2.5 mp0 -46.94 -39.19 11.84 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.083 -1.011 . . . . 0.0 110.087 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.506 ' CD2' HE22 ' A' ' 41' ' ' GLN . 2.9 t60 -53.18 -24.65 11.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.576 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -72.3 -25.77 61.71 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.175 -0.953 . . . . 0.0 109.074 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.447 HG12 ' CE2' ' A' ' 48' ' ' PHE . 7.4 mt -83.35 -15.81 11.41 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 O-C-N 121.104 -0.998 . . . . 0.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -88.3 -53.18 4.82 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.986 -1.071 . . . . 0.0 110.665 -179.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.562 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -102.79 55.87 0.77 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.509 -0.745 . . . . 0.0 111.681 -177.427 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.576 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 34.4 m -155.38 63.64 0.62 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.93 -1.106 . . . . 0.0 109.792 179.046 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.596 ' C ' ' H ' ' A' ' 55' ' ' ASP . 10.2 p -87.75 158.67 18.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.146 -0.971 . . . . 0.0 110.029 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -60.23 12.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.333 -0.854 . . . . 0.0 110.56 -179.69 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.596 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -111.23 27.79 9.35 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 109.878 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.536 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.0 OUTLIER -148.21 148.76 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.087 -1.008 . . . . 0.0 109.816 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.561 ' H ' ' CD ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -125.99 128.75 47.96 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.459 -0.776 . . . . 0.0 109.625 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.598 HD13 ' HB ' ' A' ' 28' ' ' THR . 2.7 pp -172.64 -173.38 1.0 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.046 -1.034 . . . . 0.0 109.985 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.564 ' N ' ' CD1' ' A' ' 59' ' ' PHE . 3.4 m-85 -114.68 159.18 20.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.354 -0.842 . . . . 0.0 108.812 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 79' ' ' ILE . . . -139.34 150.99 46.01 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.789 -1.194 . . . . 0.0 109.143 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.516 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 28.1 t80 -148.86 97.11 2.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.175 -0.953 . . . . 0.0 109.181 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -117.07 152.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.071 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.9 119.07 22.26 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.491 -0.756 . . . . 0.0 109.163 179.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -100.47 156.22 17.39 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 0.0 109.573 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.0 t -77.73 141.64 39.19 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.17 -0.956 . . . . 0.0 108.975 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.426 ' HB ' ' HB2' ' A' ' 69' ' ' ALA . 1.7 m -109.9 -24.05 11.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.472 -0.767 . . . . 0.0 109.42 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.581 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 81.04 106.33 0.32 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 59.34 -76.11 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -1.16 . . . . 0.0 109.465 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 67' ' ' GLY . . . 50.81 -169.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 0.0 109.423 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.486 ' C ' ' H ' ' A' ' 72' ' ' LYS . 0.0 OUTLIER -137.83 121.83 17.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.46 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.14 1.22 0.33 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.315 -0.866 . . . . 0.0 109.455 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.486 ' H ' ' C ' ' A' ' 70' ' ' MET . 77.8 mttt -147.98 62.97 1.12 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.198 -0.939 . . . . 0.0 109.465 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 72' ' ' LYS . 2.3 mtt180 -43.29 -54.47 4.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.193 -0.942 . . . . 0.0 109.475 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.87 157.03 17.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.8 mmtt -104.63 158.09 16.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 109.813 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.49 ' O ' ' N ' ' A' ' 109' ' ' ALA . 65.7 m-85 -133.5 118.99 18.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.486 -0.759 . . . . 0.0 109.459 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.28 160.33 41.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.407 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.481 HD12 ' OH ' ' A' ' 14' ' ' TYR . 5.3 tt -105.99 157.13 17.73 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.593 HG21 HD11 ' A' ' 120' ' ' LEU . 2.8 mt -135.13 136.1 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.072 -1.017 . . . . 0.0 108.961 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -95.96 117.16 30.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.584 ' N ' ' O ' ' A' ' 58' ' ' LEU . 66.8 t-105 -95.22 111.25 23.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.869 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.415 ' O ' ' C ' ' A' ' 83' ' ' GLY . 4.4 mm -116.41 92.77 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.66 161.77 0.06 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -88.85 -27.49 21.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.344 -1.092 . . . . 0.0 109.565 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.9 47.59 0.87 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.323 -0.86 . . . . 0.0 109.664 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.23 166.26 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.286 -0.884 . . . . 0.0 109.733 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.533 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 11.2 t -87.11 -170.92 3.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.398 -0.814 . . . . 0.0 109.748 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.533 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.2 -16.64 66.56 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -45.93 -41.37 11.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.134 -1.215 . . . . 0.0 109.822 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.651 ' H ' ' CD ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -68.76 -29.38 67.76 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.113 -0.992 . . . . 0.0 109.076 179.641 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.439 ' N ' ' O ' ' A' ' 88' ' ' GLY . 10.0 tmm_? -53.59 -60.78 2.87 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 110.206 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.62 -42.63 34.27 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.11 -0.994 . . . . 0.0 110.131 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -61.96 -63.65 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.102 -0.999 . . . . 0.0 110.049 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.405 HG23 ' OH ' ' A' ' 31' ' ' TYR . 13.6 m -45.33 -51.56 10.92 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.152 -0.967 . . . . 0.0 109.806 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -43.19 -65.46 1.45 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -49.48 72.93 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.106 -1.232 . . . . 0.0 111.34 -178.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.617 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.1 OUTLIER -68.23 -39.75 82.22 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.87 -1.144 . . . . 0.0 111.593 -177.589 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -23.95 64.67 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 120.732 -1.23 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.0 m -83.32 -20.52 34.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 108.694 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -79.56 -61.22 2.07 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.433 -0.792 . . . . 0.0 109.366 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.1 p -56.46 -28.37 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.244 -0.91 . . . . 0.0 109.971 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.864 ' O ' HG12 ' A' ' 105' ' ' VAL . 16.4 tttt -71.55 -39.56 70.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.127 -0.983 . . . . 0.0 109.708 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.62 -31.4 69.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.111 -0.993 . . . . 0.0 110.097 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.6 t -97.14 36.92 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 102' ' ' LYS . 8.4 p -119.53 66.02 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.272 -0.892 . . . . 0.0 109.404 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.15 42.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.204 -0.935 . . . . 0.0 109.802 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -136.33 -31.04 0.9 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.553 ' C ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -72.78 -164.65 0.17 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.323 -0.861 . . . . 0.0 110.104 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -132.6 -27.58 1.71 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.504 -0.747 . . . . 0.0 109.091 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 21.3 tttp -162.2 150.63 14.87 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.304 -0.873 . . . . 0.0 109.404 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.81 149.23 25.83 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.241 -0.912 . . . . 0.0 109.278 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -135.74 153.98 51.39 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.343 -0.848 . . . . 0.0 109.966 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 5.8 p -120.9 137.7 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.65 HG22 ' H ' ' A' ' 116' ' ' ASP . 4.4 mm -127.07 160.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.858 . . . . 0.0 110.433 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.518 ' N ' HG22 ' A' ' 114' ' ' ILE . 14.3 t -140.63 5.64 2.01 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.65 ' H ' HG22 ' A' ' 114' ' ' ILE . 49.6 m-20 -146.06 155.3 42.69 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.37 -0.831 . . . . 0.0 109.392 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -75.99 -30.93 58.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.241 -0.912 . . . . 0.0 110.045 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -76.17 -7.73 55.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.145 -0.972 . . . . 0.0 109.368 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.907 ' OE1' ' CE1' ' A' ' 124' ' ' PHE . 2.4 mm-40 -86.58 3.87 42.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.205 -0.934 . . . . 0.0 109.785 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.593 HD11 HG21 ' A' ' 79' ' ' ILE . 1.6 tp -98.91 -0.35 42.46 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.236 -0.915 . . . . 0.0 108.993 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.19 144.41 12.55 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.578 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 122' ' ' GLU . 1.0 OUTLIER -61.36 -48.58 80.62 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.244 -0.91 . . . . 0.0 109.78 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -56.23 -20.42 18.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.921 . . . . 0.0 109.679 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.907 ' CE1' ' OE1' ' A' ' 119' ' ' GLU . 78.3 t80 -86.67 -50.69 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.169 -0.957 . . . . 0.0 109.269 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -73.7 -25.62 20.89 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -69.47 -51.83 32.35 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.174 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.3 t -63.81 -17.95 63.62 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.275 -0.89 . . . . 0.0 109.325 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -73.06 -42.11 63.43 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.238 -0.914 . . . . 0.0 109.265 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 34.9 mt -73.19 -51.13 18.94 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.276 -0.89 . . . . 0.0 109.099 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -53.88 -15.85 1.53 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.139 -0.976 . . . . 0.0 109.586 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -74.84 -68.42 0.55 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.273 -0.892 . . . . 0.0 109.451 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.89 76.51 1.16 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.22 -0.925 . . . . 0.0 109.479 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -92.68 94.83 1.93 Allowed Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 54.12 -118.39 9.11 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -143.61 22.07 1.82 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.26 -1.141 . . . . 0.0 109.502 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.441 ' OD1' ' N ' ' A' ' 136' ' ' ASN . 1.5 m120 -61.93 -34.82 76.79 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.165 -0.959 . . . . 0.0 109.517 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -83.67 2.12 39.15 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.277 -0.889 . . . . 0.0 109.519 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.45 -37.08 12.14 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 109.471 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -100.79 10.43 41.15 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.287 -0.883 . . . . 0.0 109.472 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -154.91 109.68 3.01 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.24 -0.913 . . . . 0.0 109.492 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.3 p -90.21 -154.09 0.32 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.224 -0.922 . . . . 0.0 109.511 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 117.96 -1.019 . . . . 0.0 109.454 180.0 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.678 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.678 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 76.05 159.32 0.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.419 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m -158.02 147.57 19.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.21 -0.932 . . . . 0.0 109.457 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 35' ' ' THR . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.724 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.621 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.423 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.587 ' O ' ' NE ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -79.65 -7.96 58.9 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.574 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -92.34 158.09 16.28 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.24 -0.913 . . . . 0.0 109.444 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.69 38.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.202 -0.936 . . . . 0.0 109.815 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . 174.35 -91.77 0.09 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.729 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.7 OUTLIER 74.15 -55.11 0.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -1.064 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.729 ' HB3' ' O ' ' A' ' 22' ' ' SER . . . 84.16 52.82 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.804 ' O ' HG22 ' A' ' 24' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.709 HG22 ' O ' ' A' ' 42' ' ' GLY . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.688 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.621 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.771 ' OH ' HG23 ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.447 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.709 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.614 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.446 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.591 ' O ' HG23 ' A' ' 53' ' ' THR . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 24.2 mm-40 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.463 ' SG ' HD21 ' A' ' 120' ' ' LEU . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.521 ' HD2' ' H ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.553 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.825 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.633 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER -109.82 77.29 1.04 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.1 130.36 4.24 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.737 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 0.0 OUTLIER -79.08 91.66 4.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -1.133 . . . . 0.0 109.481 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.7 ' HB2' ' O ' ' A' ' 68' ' ' ASP . . . 164.83 132.08 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.23 -0.919 . . . . 0.0 109.445 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.552 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 6.3 tpt 54.88 -82.78 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.46 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.578 ' N ' ' O ' ' A' ' 69' ' ' ALA . 1.7 m 54.01 80.27 0.12 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.42 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -86.53 -11.39 51.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.235 -0.916 . . . . 0.0 109.56 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.8 mtt180 -159.33 96.27 1.29 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.248 -0.907 . . . . 0.0 109.634 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.825 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -50.45 -178.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.714 ' HD3' HD13 ' A' ' 129' ' ' LEU . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.454 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.62 ' CG2' HD12 ' A' ' 114' ' ' ILE . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.441 HG23 ' CD2' ' A' ' 59' ' ' PHE . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 80' ' ' THR . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.525 ' N ' ' CD ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' THR . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.771 HG23 ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' ALA . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.415 ' OD2' HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 104' ' ' VAL . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.427 ' O ' HG12 ' A' ' 105' ' ' VAL . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.558 ' O ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.62 HD12 ' CG2' ' A' ' 79' ' ' ILE . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.661 ' H ' ' CD ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.714 HD13 ' HD3' ' A' ' 75' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.33 -7.73 0.26 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.549 ' H ' ' C ' ' A' ' 129' ' ' LEU . 7.3 ttpp 61.26 104.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.797 0.808 . . . . 0.0 109.338 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -139.25 -32.35 0.66 Allowed 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -47.33 162.43 0.26 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -137.58 167.15 24.88 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . -162.87 24.47 0.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -1.164 . . . . 0.0 109.501 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ASN . . . . . 0.503 ' C ' ' H ' ' A' ' 138' ' ' ASP . 1.0 OUTLIER 65.94 -74.02 0.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 109.567 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' ALA . 74.4 t80 53.05 6.74 0.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.276 -0.89 . . . . 0.0 109.438 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.503 ' H ' ' C ' ' A' ' 136' ' ' ASN . 12.6 t0 -165.29 -87.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -145.86 83.48 1.64 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.527 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 48.84 -99.52 0.06 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.241 -0.912 . . . . 0.0 109.432 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -173.36 4.06 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.911 . . . . 0.0 109.438 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.515 -179.982 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 mtt . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.331 0.586 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 3' ' ' THR . . . -70.86 140.2 51.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.204 -0.935 . . . . 0.0 109.476 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.473 ' O ' ' O ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER 60.33 138.67 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -0.887 . . . . 0.0 109.513 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -140.95 118.24 11.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.302 -0.874 . . . . 0.0 109.344 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 1.614 HD11 ' CG1' ' A' ' 101' ' ' VAL . 15.0 tt -107.53 146.39 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.626 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.8 p30 -75.72 -51.99 11.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.083 -1.01 . . . . 0.0 110.829 -178.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.8 ' CD ' HG21 ' A' ' 104' ' ' VAL . 5.7 mttm 64.29 -43.06 0.28 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.296 -0.877 . . . . 0.0 109.797 -179.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.8 tm-20 -46.36 -38.83 9.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 109.843 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.9 -60.03 2.47 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.188 -0.945 . . . . 0.0 109.487 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -44.91 -69.65 0.13 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.377 -0.827 . . . . 0.0 110.159 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -45.45 -56.18 5.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.63 -43.96 69.14 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.189 -0.945 . . . . 0.0 110.253 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.657 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -78.01 -45.61 23.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.007 -1.058 . . . . 0.0 110.369 -179.123 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 3.0 m-30 -45.43 -55.2 6.37 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 110.249 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.53 ' ND2' ' OD1' ' A' ' 107' ' ' ASN . 0.3 OUTLIER -71.23 -21.64 62.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.062 -1.024 . . . . 0.0 109.803 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.7 tp -72.18 -41.2 67.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.215 -0.928 . . . . 0.0 109.872 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.657 HG13 ' O ' ' A' ' 13' ' ' ALA . 0.9 OUTLIER -69.82 -10.22 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 109.462 -179.754 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.534 ' O ' ' N ' ' A' ' 20' ' ' ASP . 10.0 ttm180 -76.87 -25.7 53.38 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.239 -0.913 . . . . 0.0 109.306 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -65.45 64.94 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.286 -0.884 . . . . 0.0 109.512 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.534 ' N ' ' O ' ' A' ' 18' ' ' ARG . 33.5 m-20 52.05 25.42 3.18 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.168 -0.958 . . . . 0.0 109.666 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.78 53.9 24.97 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.36 4.81 52.63 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.289 -1.124 . . . . 0.0 109.671 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -140.9 -135.93 0.11 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.149 -0.969 . . . . 0.0 109.988 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.541 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.5 OUTLIER -70.06 128.66 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.415 -0.803 . . . . 0.0 109.907 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.823 HG23 ' CD1' ' A' ' 26' ' ' TRP . 12.3 tt -61.89 -34.26 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.108 -0.995 . . . . 0.0 108.757 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.823 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.1 p-90 -160.29 151.96 19.86 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.268 -0.895 . . . . 0.0 109.386 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.6 m -119.22 141.67 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.442 -0.786 . . . . 0.0 109.355 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.586 ' HB ' HD13 ' A' ' 58' ' ' LEU . 41.3 p -131.99 136.31 47.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.863 . . . . 0.0 109.547 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.496 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.36 163.86 15.72 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.452 ' O ' ' C ' ' A' ' 31' ' ' TYR . 10.6 ptm180 -140.81 147.76 39.54 Favored 'General case' 0 C--N 1.289 -2.029 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.443 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.661 ' OH ' ' OD1' ' A' ' 97' ' ' ASP . 3.9 m-85 -39.85 98.68 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.73 -0.607 . . . . 0.0 110.241 -178.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 1.184 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -96.86 101.42 13.0 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.554 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 51.5 -119.89 9.09 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 108.683 -1.767 . . . . 0.0 108.683 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.96 21.58 17.33 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.364 -1.08 . . . . 0.0 110.095 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . 1.184 ' O ' ' OD1' ' A' ' 32' ' ' ASP . 1.4 m -142.3 133.1 25.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 109.781 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.478 HD11 ' CE1' ' A' ' 31' ' ' TYR . 1.6 mp -80.64 110.56 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.349 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.932 HG13 ' OD1' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -135.5 153.49 77.76 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.358 -0.839 . . . . 0.0 109.63 -179.698 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 37' ' ' VAL . 86.4 Cg_exo -33.84 146.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.993 2.462 . . . . 0.0 112.316 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.2 -26.36 0.15 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.545 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -142.89 -178.56 5.87 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.421 -1.046 . . . . 0.0 109.466 -179.475 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.604 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -160.44 177.64 10.36 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 121.746 0.784 . . . . 0.0 110.736 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.758 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -163.69 135.82 3.97 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -108.03 -5.44 17.06 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -159.02 175.4 13.58 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -11.24 60.0 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.17 -0.956 . . . . 0.0 109.527 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -78.14 -31.77 49.98 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.936 -1.103 . . . . 0.0 110.149 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.59 -42.9 91.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.002 -1.061 . . . . 0.0 109.549 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.587 ' C ' ' CD1' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -55.83 -31.22 62.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.342 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.45 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.3 mt -83.2 -13.96 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.016 -1.052 . . . . 0.0 109.999 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.18 -52.53 5.36 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.612 -1.305 . . . . 0.0 109.77 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.545 ' NE2' ' CG ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -100.74 55.05 0.86 Allowed 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 110.896 -178.413 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.9 t -154.0 67.14 0.73 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.003 -1.06 . . . . 0.0 109.64 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.59 ' C ' ' H ' ' A' ' 55' ' ' ASP . 7.6 p -84.44 154.9 22.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.248 -0.907 . . . . 0.0 110.003 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER -58.05 8.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.478 -0.763 . . . . 0.0 110.482 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.59 ' H ' ' C ' ' A' ' 53' ' ' THR . 2.5 m-20 -109.95 26.78 10.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 0.0 109.366 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.555 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.8 OUTLIER -147.27 148.0 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 109.63 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.581 ' NH2' ' O ' ' A' ' 83' ' ' GLY . 3.2 ptp180 -130.47 133.61 46.43 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 110.329 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.775 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.0 pp -172.63 179.51 2.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.698 . . . . 0.0 109.279 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.513 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.77 154.24 27.71 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.044 -1.035 . . . . 0.0 109.162 179.814 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.423 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -139.39 159.14 42.85 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.015 -1.053 . . . . 0.0 109.294 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 15.0 t80 -148.5 107.56 3.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.641 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -121.48 153.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.339 -0.85 . . . . 0.0 109.641 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -87.08 108.39 18.86 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -90.2 155.5 18.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.278 -0.888 . . . . 0.0 109.927 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.417 ' H ' HG22 ' A' ' 65' ' ' THR . 1.0 OUTLIER -80.74 140.04 35.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 108.809 179.339 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.7 m -146.68 110.68 5.01 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.141 -0.974 . . . . 0.0 109.547 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.499 ' C ' ' H ' ' A' ' 69' ' ' ALA . . . 73.29 60.44 3.8 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.433 ' C ' ' OD1' ' A' ' 68' ' ' ASP . 55.8 p30 -70.45 38.29 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -1.122 . . . . 0.0 109.476 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.499 ' H ' ' C ' ' A' ' 67' ' ' GLY . . . -100.43 159.8 14.85 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 109.454 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.423 ' C ' ' O ' ' A' ' 69' ' ' ALA . 27.2 mtt 43.83 -105.11 0.08 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.226 -0.921 . . . . 0.0 109.517 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.02 144.76 32.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.222 -0.924 . . . . 0.0 109.471 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.9 mttm -78.14 73.35 4.7 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.245 -0.909 . . . . 0.0 109.492 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.664 ' CG ' HH11 ' A' ' 73' ' ' ARG . 1.6 mtt-85 -74.19 173.84 9.57 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.931 . . . . 0.0 109.458 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -150.0 157.07 42.78 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.3 -0.875 . . . . 0.0 109.456 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.659 ' HG2' HD22 ' A' ' 129' ' ' LEU . 14.5 tptm -105.22 153.84 21.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 109.751 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.471 ' O ' ' N ' ' A' ' 109' ' ' ALA . 78.6 m-85 -126.88 120.47 29.3 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.492 -0.755 . . . . 0.0 109.371 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.18 160.4 41.5 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.003 . . . . 0.0 110.496 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.8 tt -108.78 158.0 18.05 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.4 mt -138.31 143.64 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 120.931 -1.105 . . . . 0.0 108.928 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.22 120.26 41.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.193 -0.942 . . . . 0.0 109.696 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.555 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 61.1 t-105 -93.15 112.02 23.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.136 -0.977 . . . . 0.0 109.611 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.1 93.24 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 108.807 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.581 ' O ' ' NH2' ' A' ' 57' ' ' ARG . . . -64.67 160.4 41.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 54' ' ' ASP . 2.4 mm-40 -121.13 71.43 0.95 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.617 -0.931 . . . . 0.0 109.766 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.513 ' O ' ' O ' ' A' ' 86' ' ' VAL . 0.4 OUTLIER -178.12 -24.93 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.05 -1.031 . . . . 0.0 110.067 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.513 ' O ' ' O ' ' A' ' 85' ' ' ASP . 1.9 t -59.51 -134.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.064 -1.022 . . . . 0.0 109.787 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.7 m -125.93 -177.73 4.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.507 -0.746 . . . . 0.0 110.121 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.15 -18.04 63.65 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.903 -1.279 . . . . 0.0 109.903 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mp -47.69 -57.05 6.01 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.186 -1.184 . . . . 0.0 109.864 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.497 ' O ' ' N ' ' A' ' 94' ' ' THR . 1.0 OUTLIER -62.37 -31.38 72.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.192 -0.942 . . . . 0.0 109.729 -179.708 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 4.5 tpt180 -45.09 -65.79 0.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.753 -1.217 . . . . 0.0 110.042 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.61 -33.4 66.66 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.146 -0.971 . . . . 0.0 110.235 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.527 ' HG3' ' HH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -69.47 -58.66 3.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.132 -0.98 . . . . 0.0 109.87 -179.59 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.497 ' N ' ' O ' ' A' ' 90' ' ' GLN . 3.5 m -44.64 -36.4 3.07 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.144 -0.972 . . . . 0.0 109.362 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -57.53 -57.1 21.55 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 m -66.45 -47.28 73.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.956 -1.32 . . . . 0.0 111.143 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.661 ' OD1' ' OH ' ' A' ' 31' ' ' TYR . 3.0 m-20 -69.17 -43.27 74.58 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.745 -1.222 . . . . 0.0 111.434 -177.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.88 -26.11 33.48 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.68 -1.262 . . . . 0.0 108.702 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.5 m -75.66 -29.85 59.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.318 -0.864 . . . . 0.0 108.917 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.7 -58.47 5.03 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 1.614 ' CG1' HD11 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -65.85 -25.92 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.122 -0.986 . . . . 0.0 110.441 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.5 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.4 tttp -70.68 -37.99 73.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.06 -1.025 . . . . 0.0 109.945 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.456 ' C ' ' H ' ' A' ' 105' ' ' VAL . 27.6 tt0 -79.26 -37.35 38.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.528 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.8 HG21 ' CD ' ' A' ' 7' ' ' LYS . 2.9 p -73.19 18.56 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.016 -1.053 . . . . 0.0 110.029 -179.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 102' ' ' LYS . 4.5 p -98.31 133.5 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.107 -0.996 . . . . 0.0 109.635 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.973 ' C ' HD21 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -138.8 31.15 2.26 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.382 -0.969 . . . . 0.0 108.382 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.973 HD21 ' C ' ' A' ' 106' ' ' GLN . 1.9 m120 -136.09 -22.95 1.35 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.611 -0.68 . . . . 0.0 110.118 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PHE . . . . . 0.572 ' C ' ' CD1' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -81.92 168.35 18.0 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.957 -1.089 . . . . 0.0 110.281 -179.491 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -109.07 -29.33 8.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.566 -0.709 . . . . 0.0 109.166 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -162.28 151.74 15.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 109.404 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.97 154.28 20.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.324 -0.86 . . . . 0.0 109.244 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -136.46 159.13 42.71 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.268 -0.895 . . . . 0.0 109.9 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.6 p -121.67 144.23 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.561 HG22 ' H ' ' A' ' 116' ' ' ASP . 4.7 mm -129.13 158.51 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.166 -0.959 . . . . 0.0 110.172 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.484 ' N ' HG22 ' A' ' 114' ' ' ILE . 88.8 p -138.73 2.2 2.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.561 ' H ' HG22 ' A' ' 114' ' ' ILE . 4.1 m-20 -145.35 154.1 41.95 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.881 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.9 ttp180 -73.56 -31.36 63.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.215 -0.928 . . . . 0.0 109.856 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.78 -6.99 54.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.129 -0.982 . . . . 0.0 109.483 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.599 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 4.4 mm-40 -86.45 3.54 43.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.103 -0.998 . . . . 0.0 109.778 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.442 HD13 ' CE1' ' A' ' 48' ' ' PHE . 2.4 mt -105.97 13.95 28.61 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 109.001 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -64.62 148.54 50.68 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.514 -0.741 . . . . 0.0 109.793 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.25 -51.78 68.49 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.187 -0.946 . . . . 0.0 109.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -55.25 -21.92 16.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 109.738 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 66.3 t80 -84.83 -49.07 8.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.88 . . . . 0.0 109.143 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -69.32 -12.45 16.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -82.37 -50.31 9.05 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.145 -0.972 . . . . 0.0 109.644 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -24.13 67.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.221 -0.925 . . . . 0.0 110.458 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 129' ' ' LEU . 15.3 pt-20 -85.3 -39.77 17.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.96 -1.088 . . . . 0.0 109.713 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.659 HD22 ' HG2' ' A' ' 75' ' ' LYS . 5.4 mt -75.3 -36.26 61.17 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.121 -0.987 . . . . 0.0 108.664 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.2 -9.84 0.17 Allowed 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.55 ' N ' ' C ' ' A' ' 129' ' ' LEU . 8.5 tttp 61.84 106.13 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.817 0.818 . . . . 0.0 109.367 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -147.69 39.14 0.95 Allowed 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.848 -0.741 . . . . 0.0 109.513 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 49.5 -160.04 1.02 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 149.98 30.46 0.05 OUTLIER Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -157.67 -67.48 0.09 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.307 -1.114 . . . . 0.0 109.526 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -77.43 -22.44 51.47 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.255 -0.903 . . . . 0.0 109.524 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.98 -23.8 61.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.284 -0.885 . . . . 0.0 109.429 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ASP . . . . . 0.557 ' N ' ' OD1' ' A' ' 138' ' ' ASP . 0.3 OUTLIER -152.94 70.18 0.87 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.213 -0.93 . . . . 0.0 109.498 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -78.42 -56.57 4.34 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.212 -0.93 . . . . 0.0 109.414 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -86.82 -139.86 0.09 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.282 -0.886 . . . . 0.0 109.535 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -143.63 94.73 2.64 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.92 . . . . 0.0 109.541 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.51 -179.962 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.556 HG21 ' OD1' ' A' ' 97' ' ' ASP . 19.7 m . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.28 118.36 18.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.415 -0.803 . . . . 0.0 109.079 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -107.57 139.62 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.333 -0.854 . . . . 0.0 109.89 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.591 ' O ' ' N ' ' A' ' 8' ' ' GLU . 46.9 t0 -100.54 35.71 2.07 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.273 -0.892 . . . . 0.0 108.989 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.725 ' HD2' HG11 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -43.63 -16.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.933 . . . . 0.0 109.4 -179.62 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.591 ' N ' ' O ' ' A' ' 6' ' ' ASP . 5.3 tt0 -54.11 -40.54 67.39 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.168 -0.957 . . . . 0.0 108.823 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -68.22 -63.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.384 -0.822 . . . . 0.0 108.804 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.647 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.2 m -44.65 -53.28 7.38 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.294 -0.879 . . . . 0.0 109.009 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 10' ' ' CYS . 20.6 ttt180 -43.55 -59.73 2.05 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.099 -1.0 . . . . 0.0 109.456 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.42 -40.79 2.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.389 -0.819 . . . . 0.0 109.556 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.86 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -86.46 -35.9 19.38 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.088 -1.008 . . . . 0.0 110.018 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.576 ' CE1' ' CZ ' ' A' ' 61' ' ' PHE . 1.2 t80 -45.44 -67.95 0.24 Allowed 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.431 -0.793 . . . . 0.0 110.36 -179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.643 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 0.4 OUTLIER -75.69 -32.74 60.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.356 -0.84 . . . . 0.0 110.746 -178.72 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.539 ' C ' ' H ' ' A' ' 18' ' ' ARG . 12.6 tp -69.13 -27.89 65.97 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.749 -1.22 . . . . 0.0 109.146 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.86 HG23 ' O ' ' A' ' 13' ' ' ALA . 22.5 t -58.66 -1.65 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.539 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.592 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.651 ' O ' HG13 ' A' ' 24' ' ' VAL . 6.9 p -46.44 91.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.992 -1.067 . . . . 0.0 108.932 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.5 tt -43.98 -54.07 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 121.25 -0.906 . . . . 0.0 109.7 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.653 ' CZ3' HG23 ' A' ' 28' ' ' THR . 41.8 p-90 -143.99 166.71 24.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.505 -1.372 . . . . 0.0 111.498 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.582 HG21 ' HB3' ' A' ' 13' ' ' ALA . 4.1 m -136.34 138.84 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.602 -0.686 . . . . 0.0 109.4 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.653 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 46.8 p -125.87 141.14 52.13 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.308 -0.87 . . . . 0.0 110.173 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.647 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.21 160.89 25.6 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.662 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -137.87 146.69 43.69 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 121.243 -0.911 . . . . 0.0 109.59 -179.598 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.567 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 4.7 m-85 -59.75 98.5 0.05 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.462 -0.774 . . . . 0.0 110.019 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.574 ' OD1' ' N ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -94.97 102.16 13.97 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.375 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.97 -119.84 7.0 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.2 26.89 10.1 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.325 -1.103 . . . . 0.0 110.615 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.484 ' C ' HD12 ' A' ' 36' ' ' ILE . 8.3 m -145.57 151.17 37.7 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.854 -1.154 . . . . 0.0 110.686 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.656 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.8 mp -101.55 107.22 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.44 HG22 ' CG ' ' A' ' 32' ' ' ASP . 0.9 OUTLIER -135.7 151.81 74.95 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.292 -0.88 . . . . 0.0 110.018 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.2 Cg_exo -31.88 139.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 123.069 2.513 . . . . 0.0 112.391 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.12 -35.56 0.21 Allowed Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.615 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.7 m-20 -142.71 -179.02 6.07 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.806 -0.82 . . . . 0.0 108.878 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.864 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -159.25 -170.19 2.89 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.368 -0.832 . . . . 0.0 110.138 -179.778 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.18 140.62 6.31 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.42 -4.78 15.4 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.04 175.22 13.79 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.429 ' O ' ' C ' ' A' ' 46' ' ' GLN . 1.3 t80 -72.18 -46.29 56.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 120.996 -1.065 . . . . 0.0 109.355 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.437 ' N ' HE21 ' A' ' 46' ' ' GLN . 14.6 mm-40 -42.22 -29.38 0.24 Allowed 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.294 -0.879 . . . . 0.0 110.077 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.746 ' CE1' HE22 ' A' ' 41' ' ' GLN . 2.7 t-160 -66.62 -47.91 71.14 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.073 -1.017 . . . . 0.0 109.135 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -42.97 -28.0 0.23 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.442 ' C ' ' H ' ' A' ' 51' ' ' GLN . 1.9 mt -75.39 -45.56 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.371 -0.83 . . . . 0.0 110.605 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -81.4 8.34 9.55 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 179.064 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.615 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -119.82 -22.3 6.86 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.257 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.518 ' O ' HG23 ' A' ' 53' ' ' THR . 0.1 OUTLIER -69.35 141.08 54.29 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.206 -0.934 . . . . 0.0 109.298 179.73 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 52' ' ' CYS . 33.0 p -157.43 114.19 2.97 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.594 -0.842 . . . . 0.0 110.741 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.569 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.5 OUTLIER -64.11 -0.53 1.21 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.434 ' H ' ' C ' ' A' ' 53' ' ' THR . 10.1 m-20 -110.12 19.12 19.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.448 -0.783 . . . . 0.0 109.373 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' OG1' ' A' ' 53' ' ' THR . 0.3 OUTLIER -144.13 166.18 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.0 110.158 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.718 HH12 ' N ' ' A' ' 91' ' ' ARG . 8.4 ptp180 -136.92 136.43 38.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.803 -0.759 . . . . 0.0 109.885 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.729 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.8 pp -172.31 166.59 5.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.395 -0.816 . . . . 0.0 109.692 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.516 ' O ' HG22 ' A' ' 28' ' ' THR . 31.4 m-85 -100.01 156.9 16.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.056 -1.028 . . . . 0.0 108.801 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.506 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -127.64 152.62 47.45 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.187 -0.946 . . . . 0.0 108.99 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.576 ' CZ ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -146.19 96.11 2.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.283 -0.886 . . . . 0.0 109.254 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -121.3 151.64 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.074 -1.016 . . . . 0.0 109.76 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.514 ' CZ ' ' OG ' ' A' ' 74' ' ' SER . 12.5 ttp180 -92.68 117.57 30.13 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -99.44 155.71 17.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.178 -0.951 . . . . 0.0 110.142 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 m -77.77 146.57 35.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.42 -0.8 . . . . 0.0 108.975 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.49 -179.955 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.514 ' OG ' ' CZ ' ' A' ' 63' ' ' ARG . 1.2 m . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tptp -105.3 161.84 13.94 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.353 -0.842 . . . . 0.0 109.711 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -133.09 124.46 27.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.429 -0.794 . . . . 0.0 109.449 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.92 159.39 43.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.839 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.71 ' O ' HD12 ' A' ' 79' ' ' ILE . 8.6 tp -111.25 150.04 30.16 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.71 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.5 mp -128.97 144.03 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.998 -1.064 . . . . 0.0 109.329 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.7 m -105.19 137.25 43.27 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.877 . . . . 0.0 109.944 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.2 t-105 -114.76 110.62 19.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.392 -0.817 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -105.95 93.49 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.16 -0.962 . . . . 0.0 109.119 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.93 155.73 29.84 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 54' ' ' ASP . 5.6 tp10 -105.92 42.9 1.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.458 -1.025 . . . . 0.0 109.521 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -161.84 19.17 0.11 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.167 -0.958 . . . . 0.0 109.613 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.567 HG21 ' HE ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -92.41 164.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.089 -1.007 . . . . 0.0 109.63 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -67.7 169.92 8.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.43 -0.794 . . . . 0.0 109.703 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.28 -16.65 66.35 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.3 mt -61.4 -70.24 0.2 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 110.347 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.437 ' HB2' HH11 ' A' ' 57' ' ' ARG . 1.4 mt-30 -52.4 -26.99 14.0 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.366 -0.834 . . . . 0.0 109.924 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.718 ' N ' HH12 ' A' ' 57' ' ' ARG . 0.5 OUTLIER -52.39 -59.5 4.35 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.046 . . . . 0.0 109.744 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.46 -23.31 66.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 109.823 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.437 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 4.0 tptp -74.91 -48.47 24.54 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.132 -0.98 . . . . 0.0 109.228 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.567 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 13.2 m -46.01 -45.93 16.18 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.218 -0.926 . . . . 0.0 109.27 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -54.53 -58.54 12.79 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.129 -1.188 . . . . 0.0 110.129 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 88.2 m -64.76 -47.31 78.64 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.037 -1.272 . . . . 0.0 111.132 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -71.95 -43.63 64.89 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.771 -1.205 . . . . 0.0 111.612 -177.574 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -54.58 -26.19 30.85 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.668 -1.27 . . . . 0.0 109.127 -179.433 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -27.36 41.54 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -0.879 . . . . 0.0 108.639 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 97' ' ' ASP . 1.9 mt -68.82 -59.22 3.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.508 -0.745 . . . . 0.0 109.607 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.0 p -62.46 -29.33 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.183 -0.948 . . . . 0.0 110.037 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -66.53 -38.16 86.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.152 -0.968 . . . . 0.0 109.663 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -67.42 -24.19 65.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.23 -0.919 . . . . 0.0 109.617 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.725 HG11 ' HD2' ' A' ' 7' ' ' LYS . 20.4 t -86.79 30.27 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.224 -0.922 . . . . 0.0 109.667 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.7 p -95.17 126.5 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.138 -0.977 . . . . 0.0 109.765 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.455 ' C ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -151.7 22.84 0.69 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.323 -0.861 . . . . 0.0 109.943 -179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.643 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -148.46 39.92 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.997 -1.064 . . . . 0.0 110.026 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.539 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -149.15 -165.71 2.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.925 -1.11 . . . . 0.0 110.596 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.426 ' N ' ' CG ' ' A' ' 108' ' ' PHE . . . -118.14 -50.55 2.46 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.747 -0.595 . . . . 0.0 109.773 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.579 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -158.7 157.1 31.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.101 -0.999 . . . . 0.0 109.952 -179.722 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.588 ' OE1' ' N ' ' A' ' 112' ' ' PHE . 0.0 OUTLIER -104.87 159.79 15.52 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.465 -0.772 . . . . 0.0 108.968 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.588 ' N ' ' OE1' ' A' ' 111' ' ' GLU . 23.6 m-85 -136.15 161.72 34.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.183 -0.948 . . . . 0.0 109.772 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 80.6 t -121.36 150.38 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.51 HG22 ' N ' ' A' ' 115' ' ' SER . 56.3 mt -138.65 161.06 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 110.182 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.51 ' N ' HG22 ' A' ' 114' ' ' ILE . 0.3 OUTLIER -141.18 6.3 1.94 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.347 -0.845 . . . . 0.0 109.311 179.449 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -150.95 155.41 39.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.035 -1.04 . . . . 0.0 109.924 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -70.53 -31.96 69.24 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.262 -0.899 . . . . 0.0 109.599 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -67.77 -16.67 64.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.152 -0.967 . . . . 0.0 108.99 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.594 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.0 OUTLIER -86.54 1.64 50.9 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.339 -0.851 . . . . 0.0 109.763 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.566 HD13 ' CD1' ' A' ' 48' ' ' PHE . 6.5 mt -97.49 20.17 12.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.199 -0.938 . . . . 0.0 108.87 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -74.84 152.72 38.92 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.552 -0.718 . . . . 0.0 109.883 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.98 -48.65 57.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 109.844 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -12.32 7.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.063 -1.023 . . . . 0.0 109.744 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.594 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 9.4 t80 -86.58 -49.07 7.81 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.938 0.875 . . . . 0.0 109.371 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 3.4 mt -74.8 -26.35 19.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.729 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.575 ' NE ' ' HZ1' ' A' ' 130' ' ' LYS . 29.9 ttt180 -68.59 -54.57 15.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.9 t -63.77 -15.8 59.57 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.345 -0.847 . . . . 0.0 109.663 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.545 ' CD ' ' CD1' ' A' ' 112' ' ' PHE . 2.2 tt0 -76.6 -39.99 50.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 109.246 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 12.8 mt -73.34 -48.06 37.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.229 -0.919 . . . . 0.0 109.244 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.575 ' HZ1' ' NE ' ' A' ' 126' ' ' ARG . 13.7 mttt . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.116 -0.99 . . . . 0.0 109.376 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.768 HG21 ' OD1' ' A' ' 97' ' ' ASP . 2.7 m . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.473 ' CB ' HG23 ' A' ' 35' ' ' THR . 59.7 mttt -135.26 118.32 16.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.353 -0.842 . . . . 0.0 109.403 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -107.76 141.23 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.398 -0.814 . . . . 0.0 109.733 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -100.69 70.11 1.41 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.528 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.769 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -58.98 -24.49 62.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.243 -0.911 . . . . 0.0 109.494 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -46.06 68.14 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.449 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -67.47 0.44 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.549 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.82 -63.0 1.01 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.935 . . . . 0.0 109.845 -179.665 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 10.5 ttp180 -44.59 -56.26 4.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.909 -1.12 . . . . 0.0 109.678 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.44 -54.8 27.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.188 -0.945 . . . . 0.0 109.908 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -66.65 -43.72 83.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.134 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.54 ' CZ ' ' CB ' ' A' ' 61' ' ' PHE . 3.2 m-85 -46.8 -55.24 8.24 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.336 -0.852 . . . . 0.0 110.312 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.717 HD22 ' ND2' ' A' ' 107' ' ' ASN . 0.4 OUTLIER -78.94 -28.42 43.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.243 -0.911 . . . . 0.0 110.697 -178.703 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.405 ' HA ' HD12 ' A' ' 16' ' ' LEU . 33.7 tp -56.49 -19.29 14.68 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.792 -1.192 . . . . 0.0 109.473 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 13' ' ' ALA . 1.5 m -77.58 -2.84 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.226 -0.921 . . . . 0.0 109.415 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.1 mtm180 . . . . . 0 N--CA 1.49 1.556 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 -179.991 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.444 0.64 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.733 HG21 ' CG1' ' A' ' 27' ' ' VAL . 13.9 m -78.4 122.88 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.437 -0.789 . . . . 0.0 109.649 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.859 HG23 ' CD1' ' A' ' 26' ' ' TRP . 14.0 tt -49.96 -34.27 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 120.894 -1.129 . . . . 0.0 108.4 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.859 ' CD1' HG23 ' A' ' 25' ' ' ILE . 37.0 p-90 -160.95 171.57 18.46 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.259 -0.9 . . . . 0.0 109.402 177.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.733 ' CG1' HG21 ' A' ' 24' ' ' VAL . 34.7 m -137.0 143.59 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.249 -0.907 . . . . 0.0 109.287 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.599 HG23 ' CE3' ' A' ' 26' ' ' TRP . 46.0 p -132.47 134.71 45.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.293 -0.879 . . . . 0.0 109.701 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.421 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -123.61 153.97 39.95 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.71 150.18 52.24 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.521 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.752 ' OH ' HG23 ' A' ' 94' ' ' THR . 1.8 m-85 -55.04 99.28 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.569 -0.707 . . . . 0.0 110.443 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.87 101.08 13.16 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 65.49 -117.32 9.89 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.8 25.64 11.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -1.112 . . . . 0.0 110.113 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -145.42 150.16 36.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.73 179.735 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mt -104.15 108.44 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.334 -0.854 . . . . 0.0 108.989 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.9 m -135.49 158.76 73.74 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.254 -0.904 . . . . 0.0 109.724 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 87.6 Cg_exo -30.08 142.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 123.493 2.795 . . . . 0.0 112.689 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -140.55 -30.67 0.17 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.462 ' OD1' ' OE1' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -142.5 -178.9 5.99 Favored 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.625 -0.926 . . . . 0.0 109.263 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.786 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -162.69 175.68 11.1 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.871 -178.678 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.773 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.14 137.26 4.65 Favored Glycine 0 N--CA 1.486 1.977 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.78 -3.42 20.45 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.0 177.54 10.25 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.37 -10.58 59.54 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 120.883 -1.135 . . . . 0.0 109.218 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.511 ' N ' HE21 ' A' ' 46' ' ' GLN . 7.3 mm-40 -74.99 -36.68 61.99 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.049 -1.032 . . . . 0.0 110.255 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.546 ' O ' ' N ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -62.89 -53.3 56.32 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.966 -1.084 . . . . 0.0 109.569 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.572 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -45.45 -28.02 0.82 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.188 -0.945 . . . . 0.0 108.72 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.455 HG12 ' CE2' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -83.93 -17.01 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.272 -0.892 . . . . 0.0 110.134 179.405 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' A' ' 47' ' ' HIS . 5.3 tt0 -81.73 -54.45 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.775 -1.203 . . . . 0.0 109.176 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.593 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -72.47 -12.13 60.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.795 . . . . 0.0 109.736 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.411 ' C ' ' O ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -42.94 126.28 3.78 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.279 -0.888 . . . . 0.0 109.637 -179.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.521 ' C ' ' H ' ' A' ' 55' ' ' ASP . 5.6 p -150.62 110.49 4.08 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.873 0.844 . . . . 0.0 110.608 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -57.38 0.35 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.786 -0.571 . . . . 0.0 110.039 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.521 ' H ' ' C ' ' A' ' 53' ' ' THR . 50.7 t0 -109.05 31.86 5.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 109.56 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.37 168.31 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.022 -1.049 . . . . 0.0 110.477 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.644 HH12 ' N ' ' A' ' 91' ' ' ARG . 5.4 ptp180 -141.95 134.91 28.81 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.274 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.77 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.71 168.94 5.08 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.334 -0.854 . . . . 0.0 109.621 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -108.71 160.56 15.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.128 -0.982 . . . . 0.0 109.003 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.47 157.37 45.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.93 -1.106 . . . . 0.0 109.365 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.54 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 37.1 t80 -148.48 104.2 3.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.278 -0.889 . . . . 0.0 109.221 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -120.07 153.38 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.356 -0.84 . . . . 0.0 109.447 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.495 ' NE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ttp180 -88.36 108.58 19.42 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.476 -0.765 . . . . 0.0 109.049 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -89.24 155.69 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.339 -0.85 . . . . 0.0 109.794 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 65' ' ' THR . 13.9 t -86.16 128.35 34.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.259 -0.901 . . . . 0.0 108.882 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.556 -179.903 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.495 ' CB ' ' NE ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.404 ' NZ ' ' HB1' ' A' ' 109' ' ' ALA . 29.7 tptt -104.83 154.81 19.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.564 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -127.58 122.28 32.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.434 -0.791 . . . . 0.0 109.651 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.496 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -144.62 167.27 22.94 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.64 -179.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.952 ' O ' HD12 ' A' ' 79' ' ' ILE . 5.5 tt -122.6 157.98 30.96 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.952 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.3 mp -136.09 149.62 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.96 -1.088 . . . . 0.0 108.626 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 1.002 HG21 ' NZ ' ' A' ' 98' ' ' LYS . 55.7 m -112.66 120.09 40.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.515 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -95.18 111.87 23.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.124 -0.985 . . . . 0.0 109.853 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.0 mm -108.9 93.2 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 108.673 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.32 153.76 35.05 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -104.03 43.24 1.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.481 -1.011 . . . . 0.0 109.713 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.87 11.82 0.49 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.128 -0.982 . . . . 0.0 109.743 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 87' ' ' SER . 46.9 t -89.16 160.19 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.122 -0.986 . . . . 0.0 109.668 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 86' ' ' VAL . 0.4 OUTLIER -68.32 -176.96 0.81 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.433 -0.792 . . . . 0.0 109.796 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.21 -16.53 66.79 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.83 -70.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.167 -1.196 . . . . 0.0 110.239 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.605 ' CB ' HH11 ' A' ' 57' ' ' ARG . 76.9 mm-40 -60.04 -18.83 49.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.197 -0.94 . . . . 0.0 110.181 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.649 HH11 ' CG ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -55.25 -58.36 8.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.797 -1.189 . . . . 0.0 109.604 -179.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.89 -25.2 32.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.203 -0.936 . . . . 0.0 109.747 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.551 ' NZ ' ' OG1' ' A' ' 3' ' ' THR . 0.1 OUTLIER -72.11 -27.13 62.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 109.075 179.64 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.752 HG23 ' OH ' ' A' ' 31' ' ' TYR . 2.2 m -76.81 -52.1 10.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.396 -0.815 . . . . 0.0 109.106 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.451 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -41.77 -51.86 4.79 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.62 -56.53 9.04 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -1.15 . . . . 0.0 110.125 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.768 ' OD1' HG21 ' A' ' 3' ' ' THR . 84.4 m-20 -44.82 -37.95 4.19 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.13 -0.982 . . . . 0.0 110.52 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 1.002 ' NZ ' HG21 ' A' ' 80' ' ' THR . 0.2 OUTLIER -59.39 -43.36 92.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.775 -1.203 . . . . 0.0 108.193 179.357 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.4 m -46.83 -35.03 5.86 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.108 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.5 mt -71.18 -57.66 4.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.621 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 p -67.9 -13.68 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.169 -0.957 . . . . 0.0 110.052 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.403 ' O ' HG12 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -81.85 -42.51 19.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.0 110.363 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.66 -25.41 30.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.035 -1.041 . . . . 0.0 110.952 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.482 HG21 ' HG2' ' A' ' 7' ' ' LYS . 3.2 p -81.03 -34.09 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 120.805 -1.185 . . . . 0.0 110.169 -179.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.432 ' C ' ' O ' ' A' ' 104' ' ' VAL . 7.5 p -42.99 134.09 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.031 -1.043 . . . . 0.0 109.621 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.492 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 4.9 pt20 -141.03 26.6 2.02 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.717 ' ND2' HD22 ' A' ' 15' ' ' ASN . 96.3 m-20 -144.51 39.72 1.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.498 -0.751 . . . . 0.0 109.603 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -142.0 149.09 39.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.0 . . . . 0.0 109.766 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.404 ' HB1' ' NZ ' ' A' ' 75' ' ' LYS . . . -87.19 -33.5 19.34 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.636 ' NZ ' ' CZ ' ' A' ' 112' ' ' PHE . 0.7 OUTLIER -162.32 155.66 20.49 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.279 -0.888 . . . . 0.0 109.353 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -104.45 156.36 18.0 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.319 -0.863 . . . . 0.0 109.171 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.636 ' CZ ' ' NZ ' ' A' ' 110' ' ' LYS . 24.1 m-85 -139.67 157.39 45.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.207 -0.933 . . . . 0.0 109.895 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -119.99 109.22 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.559 -0.713 . . . . 0.0 109.305 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.469 HG23 ' HB3' ' A' ' 119' ' ' GLU . 35.3 mm -98.73 152.02 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.444 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.8 t -139.39 7.23 2.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.265 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.403 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.8 OUTLIER -142.0 155.26 45.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.511 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -70.21 -34.92 73.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.969 . . . . 0.0 109.613 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.699 ' HE2' ' OE2' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -75.28 -16.29 60.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 0.0 109.103 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.58 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.7 mp0 -86.4 -4.85 59.24 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.35 -0.844 . . . . 0.0 109.513 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.455 ' HG ' HG21 ' A' ' 114' ' ' ILE . 0.7 OUTLIER -99.65 8.74 44.12 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.255 -0.903 . . . . 0.0 108.965 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.699 ' OE2' ' HE2' ' A' ' 118' ' ' LYS . 63.7 mt-10 -63.68 139.05 58.73 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 0.0 109.505 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.744 ' OE1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -52.23 -50.62 61.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . 0.744 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.4 OUTLIER -59.05 -42.47 90.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.895 -1.128 . . . . 0.0 109.687 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.58 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 63.7 t80 -55.48 -44.73 76.78 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.009 0.909 . . . . 0.0 109.064 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -74.47 -25.23 19.21 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -67.49 -52.64 36.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.242 -0.911 . . . . 0.0 109.188 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -20.11 65.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.242 -0.911 . . . . 0.0 109.234 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -71.65 -42.54 67.41 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.307 -0.871 . . . . 0.0 109.271 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.496 HD21 ' HB2' ' A' ' 77' ' ' ALA . 3.7 mt -73.88 -51.64 15.55 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 109.042 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.3 mttm . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.209 -0.932 . . . . 0.0 109.287 179.885 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.919 HG21 ' OD1' ' A' ' 97' ' ' ASP . 7.2 m . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HB2' HG23 ' A' ' 35' ' ' THR . 45.4 mttp -123.67 129.06 50.54 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 109.532 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.503 HG23 ' O ' ' A' ' 5' ' ' ILE . 2.8 tp -107.66 125.37 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.478 -0.764 . . . . 0.0 109.315 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.4 m-20 -97.61 43.39 1.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.208 -0.932 . . . . 0.0 109.293 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -42.32 -18.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 109.53 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 6' ' ' ASP . 34.4 mt-10 -55.89 -49.41 73.5 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 108.981 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -61.64 -66.58 0.51 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.353 -0.842 . . . . 0.0 108.939 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.6 m -44.83 -59.08 2.71 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.286 -0.884 . . . . 0.0 109.17 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.411 ' O ' ' C ' ' A' ' 12' ' ' ALA . 39.0 ttp180 -44.29 -56.06 4.45 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.034 -1.041 . . . . 0.0 109.744 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.74 -50.94 5.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.349 -0.845 . . . . 0.0 109.818 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.914 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -82.93 -35.07 26.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.377 -0.827 . . . . 0.0 110.262 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.704 ' CZ ' ' CE1' ' A' ' 61' ' ' PHE . 3.1 t80 -45.55 -65.79 0.49 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.367 -0.833 . . . . 0.0 110.302 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.69 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 3.5 m-80 -70.7 -44.55 66.71 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.326 -0.859 . . . . 0.0 110.756 -178.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.814 HD13 ' C ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -51.75 -40.82 60.94 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.928 -1.107 . . . . 0.0 109.396 -179.158 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 13' ' ' ALA . 98.3 t -51.31 -2.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 120.934 -1.103 . . . . 0.0 109.735 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.604 ' H ' ' C ' ' A' ' 16' ' ' LEU . 1.6 ttp180 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.114 -0.991 . . . . 0.0 109.127 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.94 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.704 ' O ' HG13 ' A' ' 24' ' ' VAL . 13.0 p -85.53 109.97 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.909 HG23 ' CD1' ' A' ' 26' ' ' TRP . 14.0 tt -56.86 -32.89 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.121 -0.987 . . . . 0.0 108.822 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.909 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.0 p-90 -160.7 149.67 16.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.229 -0.919 . . . . 0.0 109.876 178.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.553 HG11 ' CB ' ' A' ' 13' ' ' ALA . 15.1 m -117.55 134.73 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.487 -0.758 . . . . 0.0 109.263 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.575 HG23 ' CE3' ' A' ' 26' ' ' TRP . 40.8 p -124.9 143.63 50.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.362 -0.836 . . . . 0.0 109.901 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.654 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -121.74 163.6 18.81 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -140.89 146.67 37.77 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.359 -0.838 . . . . 0.0 109.835 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.609 ' OH ' HG23 ' A' ' 94' ' ' THR . 3.3 m-85 -58.99 98.71 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.417 -0.802 . . . . 0.0 110.092 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.488 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.1 OUTLIER -100.02 101.19 12.2 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 73.08 -122.18 7.96 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.13 22.72 15.51 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.352 -1.087 . . . . 0.0 110.352 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.514 HG23 ' HB2' ' A' ' 4' ' ' LYS . 4.0 m -138.39 153.88 48.92 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.081 -1.012 . . . . 0.0 110.197 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.519 HG22 ' O ' ' A' ' 36' ' ' ILE . 1.7 mp -109.79 103.77 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.411 -0.806 . . . . 0.0 109.139 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.2 m -135.83 154.95 78.21 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.164 -0.96 . . . . 0.0 109.771 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.407 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 88.1 Cg_exo -32.27 140.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 123.231 2.621 . . . . 0.0 112.546 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -141.88 -21.51 0.25 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.551 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.18 -178.89 6.07 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.389 -1.065 . . . . 0.0 109.622 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.624 ' NE2' ' O ' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -157.74 179.81 8.86 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.627 0.727 . . . . 0.0 110.761 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.666 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -163.49 133.64 3.12 Favored Glycine 0 N--CA 1.485 1.951 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.456 ' O ' ' OD1' ' A' ' 44' ' ' ASP . . . -106.5 -8.56 17.01 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' A' ' 43' ' ' ALA . 59.5 m-20 -157.57 175.38 14.01 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.09 -41.37 67.39 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.806 -1.184 . . . . 0.0 109.267 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -51.58 -32.81 29.92 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.115 -0.991 . . . . 0.0 110.288 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.609 ' CE1' HE22 ' A' ' 41' ' ' GLN . 0.7 OUTLIER -65.37 -15.42 62.55 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.93 -1.106 . . . . 0.0 109.955 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -82.09 -27.65 32.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.941 -1.099 . . . . 0.0 108.774 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.445 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.9 mt -79.97 -19.36 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.251 -0.906 . . . . 0.0 110.91 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.546 ' NE2' ' C ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -87.02 -45.92 10.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.391 -1.443 . . . . 0.0 109.967 -179.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.601 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -105.32 56.66 0.68 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.261 -0.899 . . . . 0.0 110.884 -178.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 t -158.5 65.73 0.44 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.023 . . . . 0.0 109.501 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 55' ' ' ASP . 20.6 p -85.19 150.62 24.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -0.924 . . . . 0.0 109.915 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.495 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 2.5 p30 -51.58 -4.05 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.453 -0.779 . . . . 0.0 109.99 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.553 ' OD1' ' HB3' ' A' ' 85' ' ' ASP . 1.1 t0 -94.64 20.71 8.19 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.03 -1.044 . . . . 0.0 109.307 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.608 HG23 ' NH2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -138.72 151.2 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 0.0 109.654 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.679 ' HG2' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -130.98 131.54 44.45 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.485 -0.76 . . . . 0.0 109.801 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.759 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.66 175.52 3.43 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.995 -1.066 . . . . 0.0 110.504 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.568 ' O ' HG22 ' A' ' 28' ' ' THR . 1.0 OUTLIER -111.24 152.68 26.87 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.501 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -132.57 156.99 45.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.956 -1.09 . . . . 0.0 109.628 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.704 ' CE1' ' CZ ' ' A' ' 14' ' ' TYR . 64.5 t80 -149.46 97.02 2.58 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.217 -0.927 . . . . 0.0 109.361 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.01 156.53 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.307 -0.871 . . . . 0.0 109.467 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -79.66 113.06 17.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.427 -0.796 . . . . 0.0 109.01 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -92.59 154.65 18.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.256 -0.902 . . . . 0.0 109.72 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.2 t -78.26 163.4 25.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 108.975 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 O-C-N 121.258 -0.901 . . . . 0.0 109.518 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.416 -0.586 . . . . 0.0 109.416 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.451 ' HG3' ' HB2' ' A' ' 109' ' ' ALA . 6.9 ttmt -107.91 165.34 11.53 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.327 -0.858 . . . . 0.0 109.313 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.69 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 2.0 m-85 -133.25 128.65 36.32 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 109.813 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.78 167.06 23.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.341 -0.849 . . . . 0.0 110.581 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tt -117.41 157.65 25.84 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.492 HD11 HD12 ' A' ' 125' ' ' ILE . 3.1 mt -135.16 148.27 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.03 -1.044 . . . . 0.0 109.248 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.44 HG22 HD11 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -108.06 113.95 27.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.356 -0.84 . . . . 0.0 109.827 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.426 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 66.6 t-105 -94.66 111.17 22.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.018 -1.051 . . . . 0.0 109.604 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.44 HD11 HG22 ' A' ' 80' ' ' THR . 20.8 mm -112.24 92.99 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -53.29 149.29 12.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -94.35 35.24 1.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.32 -1.106 . . . . 0.0 109.554 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.553 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -153.29 25.97 0.53 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.679 HG21 ' HG2' ' A' ' 57' ' ' ARG . 4.0 p -98.11 159.63 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.15 -0.968 . . . . 0.0 109.725 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.4 p -71.9 -176.24 1.64 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.0 110.01 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.19 -18.19 63.28 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -46.4 -57.2 4.87 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.083 -1.245 . . . . 0.0 109.618 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 49.0 mm-40 -57.51 -30.97 65.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.208 -0.933 . . . . 0.0 109.23 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 6.6 tpt180 -45.33 -56.42 4.94 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.053 -1.03 . . . . 0.0 109.425 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.82 -35.2 38.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.823 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 10.2 mttt -69.66 -61.64 1.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.128 -0.982 . . . . 0.0 109.875 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.609 HG23 ' OH ' ' A' ' 31' ' ' TYR . 28.4 m -45.02 -49.83 11.11 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.0 109.65 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -51.66 -59.43 8.55 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 74.1 p -65.01 -48.29 74.44 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.014 -1.286 . . . . 0.0 111.173 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.919 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.0 OUTLIER -69.08 -41.1 77.97 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.82 -1.175 . . . . 0.0 111.617 -177.535 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.404 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -61.23 -22.18 64.55 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.768 -1.208 . . . . 0.0 109.459 -179.416 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 20.4 m -73.92 -44.85 53.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.227 -0.92 . . . . 0.0 109.426 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.455 ' N ' HD12 ' A' ' 100' ' ' LEU . 8.1 mp -59.13 -54.73 43.63 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.204 -0.935 . . . . 0.0 109.586 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -28.05 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.164 -0.96 . . . . 0.0 109.914 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.72 -37.93 73.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.14 -0.975 . . . . 0.0 109.784 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -22.39 60.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.158 -0.964 . . . . 0.0 109.732 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.797 HG12 ' O ' ' A' ' 104' ' ' VAL . 88.6 t -94.26 33.82 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.55 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 105' ' ' VAL . 12.1 t -131.75 98.93 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.298 -0.876 . . . . 0.0 109.873 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.595 ' O ' ' N ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -119.1 -41.4 2.75 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.69 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 33.2 p-10 -63.9 41.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 119.936 -0.705 . . . . 0.0 110.073 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.595 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -142.4 174.69 10.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.345 -0.847 . . . . 0.0 109.601 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.451 ' HB2' ' HG3' ' A' ' 75' ' ' LYS . . . -88.07 -56.76 3.19 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.205 -0.934 . . . . 0.0 109.5 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.514 ' CG ' ' N ' ' A' ' 111' ' ' GLU . 9.3 ttpp -162.37 167.17 24.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.294 -0.878 . . . . 0.0 109.33 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.514 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -104.37 154.06 20.3 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.192 -0.943 . . . . 0.0 108.968 179.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -128.61 156.2 43.74 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.444 -0.785 . . . . 0.0 110.166 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.569 ' O ' HD13 ' A' ' 114' ' ' ILE . 33.4 t -115.16 143.11 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.711 HG21 ' CD2' ' A' ' 120' ' ' LEU . 18.8 mm -136.08 154.07 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.078 -1.013 . . . . 0.0 110.439 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 64.4 m -140.59 3.6 1.9 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.611 -0.681 . . . . 0.0 109.218 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 1.164 ' OD1' ' CD ' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -143.12 155.29 44.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.189 -0.945 . . . . 0.0 109.526 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -73.96 -33.25 63.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 109.824 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.61 -8.76 54.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.199 -0.938 . . . . 0.0 109.007 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 1.164 ' CD ' ' OD1' ' A' ' 116' ' ' ASP . 21.7 mt-10 -86.35 -0.48 56.0 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.711 ' CD2' HG21 ' A' ' 114' ' ' ILE . 2.6 mm? -94.71 1.29 55.49 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.214 -0.929 . . . . 0.0 108.814 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.45 145.77 54.96 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.538 -0.726 . . . . 0.0 109.701 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -62.33 -49.24 76.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 0.0 109.581 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.15 -21.94 15.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.0 109.852 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 67.5 t80 -83.31 -49.21 9.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.301 -0.874 . . . . 0.0 109.148 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.492 HD12 HD11 ' A' ' 79' ' ' ILE . 4.5 mm -71.94 -25.2 23.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -65.09 -52.39 55.83 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.198 -0.939 . . . . 0.0 108.729 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.3 t -58.74 -24.5 61.71 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.323 -0.861 . . . . 0.0 109.197 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.84 -40.65 65.57 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.295 -0.878 . . . . 0.0 109.268 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 75' ' ' LYS . 19.2 mt -73.64 -53.11 11.21 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.219 -0.925 . . . . 0.0 109.131 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 130' ' ' LYS . 11.3 mptt . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.143 -0.973 . . . . 0.0 109.601 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -137.32 118.21 14.22 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.275 -0.891 . . . . 0.0 109.364 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.437 HG23 ' HG3' ' A' ' 7' ' ' LYS . 2.0 tt -110.79 142.72 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.404 -0.81 . . . . 0.0 109.615 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 8' ' ' GLU . 4.5 m-20 -93.4 40.84 1.07 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.189 -0.944 . . . . 0.0 109.154 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.482 ' HB3' HG11 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -40.17 -22.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.712 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.57 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.3 tt0 -50.32 -34.05 22.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.186 -0.946 . . . . 0.0 109.232 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.8 -60.25 2.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.357 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.89 -62.82 1.08 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.209 -0.932 . . . . 0.0 109.682 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.654 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 38.7 ttp180 -45.17 -53.66 7.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.951 -1.093 . . . . 0.0 109.221 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -58.29 8.49 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.339 -0.85 . . . . 0.0 109.757 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.543 ' HB3' HG11 ' A' ' 27' ' ' VAL . . . -58.55 -25.57 62.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.535 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -70.76 -48.31 55.02 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.368 -0.832 . . . . 0.0 109.492 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.735 ' ND2' HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -79.58 -11.06 59.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.272 -0.893 . . . . 0.0 109.555 -179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.416 ' HA ' HD12 ' A' ' 16' ' ' LEU . 6.6 tp -76.76 -29.01 55.93 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.265 -0.897 . . . . 0.0 109.212 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.696 HG12 HG13 ' A' ' 24' ' ' VAL . 0.8 OUTLIER -72.1 -1.57 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.298 -0.876 . . . . 0.0 109.194 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.512 ' CG ' ' O ' ' A' ' 18' ' ' ARG . 22.1 ttp180 . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.535 -0.728 . . . . 0.0 109.188 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.592 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.696 HG13 HG12 ' A' ' 17' ' ' VAL . 2.5 p -58.41 78.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.98 . . . . 0.0 108.94 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -41.02 -59.04 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 O-C-N 121.409 -0.807 . . . . 0.0 109.949 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.66 ' CE3' HG23 ' A' ' 28' ' ' THR . 27.0 p-90 -134.02 156.49 48.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.826 -1.171 . . . . 0.0 110.834 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.543 HG11 ' HB3' ' A' ' 13' ' ' ALA . 1.5 p -134.27 135.77 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.66 HG23 ' CE3' ' A' ' 26' ' ' TRP . 70.7 p -124.28 146.22 48.91 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.097 -1.002 . . . . 0.0 110.541 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.92 136.9 54.19 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 32' ' ' ASP . 26.9 ptt180 -113.47 146.1 40.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.487 -0.758 . . . . 0.0 109.982 -178.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.681 ' CD2' ' NE2' ' A' ' 90' ' ' GLN . 1.9 m-85 -41.21 98.63 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.565 -0.709 . . . . 0.0 109.781 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -97.1 101.76 13.4 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 55.83 -119.35 13.74 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.83 22.46 15.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.453 -1.028 . . . . 0.0 110.098 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 43.8 m -145.31 134.06 22.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.123 -0.986 . . . . 0.0 109.909 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.3 mp -78.98 113.45 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.284 -0.885 . . . . 0.0 108.997 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.41 150.5 72.59 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.286 -0.884 . . . . 0.0 109.871 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -35.53 146.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.895 2.397 . . . . 0.0 112.303 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.99 -38.64 0.15 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.577 ' CG ' HE22 ' A' ' 51' ' ' GLN . 3.5 m-20 -142.62 -179.38 6.27 Favored 'General case' 0 C--N 1.296 -1.761 0 O-C-N 121.714 -0.874 . . . . 0.0 109.285 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.848 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -158.12 -169.39 2.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.354 -0.841 . . . . 0.0 109.685 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.15 143.96 7.75 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 119.521 -1.323 . . . . 0.0 110.163 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.04 0.29 29.65 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.463 ' C ' HD13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.29 170.71 19.37 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.425 ' O ' ' C ' ' A' ' 46' ' ' GLN . 17.8 p90 -79.63 -39.72 30.89 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.625 -1.297 . . . . 0.0 109.03 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 45' ' ' TYR . 6.0 mm-40 -42.42 -33.84 0.73 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.078 -1.014 . . . . 0.0 109.994 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.518 ' NE2' ' OE1' ' A' ' 50' ' ' GLN . 2.1 t-160 -61.74 -41.75 98.06 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.82 -1.175 . . . . 0.0 109.108 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.648 ' CE1' HD13 ' A' ' 120' ' ' LEU . 0.1 OUTLIER -47.67 -33.22 6.56 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.404 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mt -64.63 -42.11 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.158 -0.964 . . . . 0.0 109.111 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.574 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 5.3 tm0? -86.96 -12.62 47.0 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.577 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.5 mm100 -109.97 67.25 0.64 Allowed 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.313 1.054 . . . . 0.0 110.472 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.694 ' SG ' HD11 ' A' ' 58' ' ' LEU . 1.2 m 158.61 59.19 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.009 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.524 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.4 p -77.41 164.02 25.86 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.966 -1.084 . . . . 0.0 109.707 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.3 OUTLIER -65.46 -4.52 5.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.632 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.29 14.46 31.89 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.282 -0.886 . . . . 0.0 109.504 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 53' ' ' THR . 2.5 p -138.18 157.14 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.236 -0.915 . . . . 0.0 109.745 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.522 ' N ' ' CD ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -134.76 129.03 34.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.554 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.752 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.7 pp -172.49 172.73 4.25 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 110.294 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.515 ' O ' HG22 ' A' ' 28' ' ' THR . 2.7 m-85 -104.34 153.55 20.92 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.117 -0.99 . . . . 0.0 108.846 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.427 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.05 156.93 46.48 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.404 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 47.7 t80 -148.91 96.54 2.57 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -113.5 159.27 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.31 -0.868 . . . . 0.0 109.609 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.583 ' NE ' ' OG ' ' A' ' 74' ' ' SER . 1.1 ttt-85 -84.7 140.65 31.14 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.299 -0.875 . . . . 0.0 108.735 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -123.62 156.05 36.55 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.807 . . . . 0.0 110.221 -179.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.6 t -77.22 135.11 38.46 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.476 -0.765 . . . . 0.0 109.5 -179.776 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.583 ' OG ' ' NE ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.93 155.38 19.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.84 . . . . 0.0 109.311 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.442 ' O ' ' N ' ' A' ' 109' ' ' ALA . 93.8 m-85 -134.02 120.25 20.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.394 -0.816 . . . . 0.0 109.746 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.74 167.2 22.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.604 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tt -121.18 155.42 34.59 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.483 HD11 ' CD1' ' A' ' 125' ' ' ILE . 3.2 mm -134.7 143.06 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.168 -0.957 . . . . 0.0 109.046 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.42 HG23 ' CD2' ' A' ' 59' ' ' PHE . 2.7 m -104.14 117.06 33.36 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 109.674 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.5 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -92.97 111.49 23.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.048 -1.033 . . . . 0.0 109.69 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -110.11 93.12 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.323 -0.861 . . . . 0.0 108.746 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.07 158.7 3.0 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -96.95 19.88 12.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.295 -1.121 . . . . 0.0 109.734 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -132.16 26.81 4.53 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.865 . . . . 0.0 109.215 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.485 HG22 ' HD2' ' A' ' 57' ' ' ARG . 4.1 t -91.21 160.98 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.357 -0.839 . . . . 0.0 110.094 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 t -93.37 -161.32 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.379 -0.825 . . . . 0.0 108.985 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -20.62 59.19 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.969 -1.253 . . . . 0.0 109.969 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.59 -64.65 0.71 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.987 -1.302 . . . . 0.0 110.023 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.681 ' NE2' ' CD2' ' A' ' 31' ' ' TYR . 10.8 mm100 -56.75 -30.22 63.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.8 tmm_? -49.6 -59.51 3.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.798 -1.188 . . . . 0.0 109.633 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.38 -39.88 27.58 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.174 -0.954 . . . . 0.0 109.796 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.447 ' C ' ' OH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -60.27 -65.3 0.71 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 109.515 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 51.1 m -45.16 -43.11 9.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.0 109.572 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.07 -60.45 3.5 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.8 m -66.05 -47.95 72.65 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.118 -1.225 . . . . 0.0 111.075 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -68.77 -42.86 76.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.78 -1.2 . . . . 0.0 111.386 -177.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -25.12 53.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.595 -1.316 . . . . 0.0 108.745 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 96.1 m -81.33 -20.7 40.14 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 100' ' ' LEU . 53.2 mt -78.98 -63.79 1.33 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.44 -0.787 . . . . 0.0 109.185 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -50.3 -33.11 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.975 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.985 ' HE2' ' HG2' ' A' ' 111' ' ' GLU . 1.4 tttm -75.07 -42.37 57.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.269 -0.894 . . . . 0.0 109.751 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.31 -39.33 85.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.168 -0.957 . . . . 0.0 110.203 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.482 HG11 ' HB3' ' A' ' 7' ' ' LYS . 12.8 p -78.16 -25.68 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.07 -1.018 . . . . 0.0 109.926 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 102' ' ' LYS . 1.0 OUTLIER -42.8 138.4 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.105 -0.997 . . . . 0.0 109.518 -179.927 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.47 ' NE2' ' CD ' ' A' ' 11' ' ' ARG . 11.6 pt20 -144.29 20.07 1.73 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.072 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.735 HD22 ' ND2' ' A' ' 15' ' ' ASN . 1.4 t-20 -143.18 41.16 1.5 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.896 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.566 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -142.52 158.0 44.14 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.032 . . . . 0.0 109.867 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -93.6 -34.34 13.35 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.354 -0.842 . . . . 0.0 109.446 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -162.27 159.54 25.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.871 . . . . 0.0 109.314 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.985 ' HG2' ' HE2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -104.2 150.69 24.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.199 -0.938 . . . . 0.0 109.337 -179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 79' ' ' ILE . 62.0 m-85 -133.84 157.62 45.46 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.451 -0.78 . . . . 0.0 109.701 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.6 t -121.19 142.47 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.455 HD12 ' OE1' ' A' ' 119' ' ' GLU . 1.8 mm -137.26 156.59 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.899 . . . . 0.0 110.058 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.482 ' O ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -140.64 9.19 2.2 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.607 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -158.79 157.05 30.88 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.825 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -79.74 -18.96 49.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.918 -1.114 . . . . 0.0 110.209 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -62.8 -50.06 72.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.087 -1.008 . . . . 0.0 110.428 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.607 ' OE2' ' N ' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -80.79 4.74 18.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 0.0 110.279 -179.098 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.648 HD13 ' CE1' ' A' ' 48' ' ' PHE . 0.7 OUTLIER -96.38 16.62 17.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.007 -1.058 . . . . 0.0 108.405 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -74.63 154.6 38.45 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.66 -0.65 . . . . 0.0 109.78 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.41 -48.22 74.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.424 -0.798 . . . . 0.0 109.49 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 1.3 p30 -56.97 -41.59 78.62 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 109.658 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CG ' ' O ' ' A' ' 119' ' ' GLU . 15.4 t80 -60.36 -48.0 83.62 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.094 0.95 . . . . 0.0 109.093 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.483 ' CD1' HD11 ' A' ' 79' ' ' ILE . 1.4 mm -71.22 -40.15 74.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -62.14 -53.37 56.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.203 -0.935 . . . . 0.0 109.039 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -15.06 13.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.384 -0.822 . . . . 0.0 109.49 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.422 ' OE2' ' CZ ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -83.52 -37.24 23.32 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.21 -0.931 . . . . 0.0 109.358 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 46.8 mt -69.08 -39.72 78.88 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.193 -0.942 . . . . 0.0 108.631 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.303 -1.429 0 O-C-N 121.137 -0.977 . . . . 0.0 108.645 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.671 HG21 ' OD1' ' A' ' 97' ' ' ASP . 2.4 m . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.581 ' HB3' HG23 ' A' ' 35' ' ' THR . 0.1 OUTLIER -138.26 125.1 21.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.185 -0.947 . . . . 0.0 109.44 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.3 137.25 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.391 -0.818 . . . . 0.0 109.694 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.558 ' O ' ' N ' ' A' ' 8' ' ' GLU . 6.3 t70 -64.04 -44.61 91.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -0.89 . . . . 0.0 109.381 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.682 ' HD3' HG21 ' A' ' 104' ' ' VAL . 1.5 mtmt 63.89 -50.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.445 -0.785 . . . . 0.0 110.184 179.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 6' ' ' ASP . 10.9 mt-10 -51.8 -49.29 63.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.111 -0.993 . . . . 0.0 109.809 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.69 -69.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 109.999 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.613 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 4.1 m -46.08 -65.34 0.56 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.22 -0.925 . . . . 0.0 110.125 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.519 ' HG3' HH11 ' A' ' 11' ' ' ARG . 0.9 OUTLIER -44.78 -58.39 3.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.985 -1.072 . . . . 0.0 110.144 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.95 -45.28 78.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.131 -0.981 . . . . 0.0 110.049 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.425 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -75.88 -17.02 59.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.058 -1.026 . . . . 0.0 110.183 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-30 -74.27 -52.96 10.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.125 -0.984 . . . . 0.0 109.539 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.671 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 1.8 m-80 -71.93 -13.32 61.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 109.42 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.543 HD23 HG22 ' A' ' 24' ' ' VAL . 4.8 tp -70.87 -47.99 56.23 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.356 -0.84 . . . . 0.0 109.575 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 14' ' ' TYR . 18.7 m -64.97 -14.0 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.218 -0.926 . . . . 0.0 109.563 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.573 ' NH2' ' OD1' ' A' ' 15' ' ' ASN . 20.1 ttm180 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.267 -0.896 . . . . 0.0 109.508 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.543 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.806 HG23 ' O ' ' A' ' 24' ' ' VAL . 9.1 m 21.5 69.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-O 120.821 0.343 . . . . 0.0 111.378 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.796 HG23 ' CD1' ' A' ' 26' ' ' TRP . 13.0 tt -46.77 -31.06 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 120.743 -1.223 . . . . 0.0 108.08 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.796 ' CD1' HG23 ' A' ' 25' ' ' ILE . 22.8 p-90 -157.16 147.63 21.22 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.295 -0.878 . . . . 0.0 109.372 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.425 HG21 ' HB3' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -112.84 135.09 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.334 -0.854 . . . . 0.0 110.091 -179.381 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.624 HG22 ' O ' ' A' ' 59' ' ' PHE . 47.5 p -131.18 133.88 45.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.48 -0.762 . . . . 0.0 109.73 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.613 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.44 167.28 14.06 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -140.89 143.75 34.84 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 119.231 -0.987 . . . . 0.0 109.813 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.638 ' OH ' HG23 ' A' ' 94' ' ' THR . 5.6 m-85 -50.37 98.68 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.544 -0.723 . . . . 0.0 109.744 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.66 101.35 13.04 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.08 -122.71 13.39 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.89 22.31 16.09 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.46 -1.023 . . . . 0.0 110.227 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.581 HG23 ' HB3' ' A' ' 4' ' ' LYS . 35.4 m -146.6 136.0 22.86 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.066 -1.021 . . . . 0.0 109.694 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mp -77.56 115.8 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.108 -0.995 . . . . 0.0 108.768 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -135.31 154.13 78.47 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.244 -0.91 . . . . 0.0 109.822 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -39.67 141.59 0.55 Allowed 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.752 2.301 . . . . 0.0 112.388 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.28 -40.8 0.17 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.568 ' CG ' ' H ' ' A' ' 41' ' ' GLN . 14.8 t70 -144.19 179.65 7.09 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.75 -0.853 . . . . 0.0 108.83 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.89 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -140.81 177.11 8.26 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.406 -0.808 . . . . 0.0 110.546 -179.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.611 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -112.19 85.14 0.38 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.592 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -113.77 43.74 1.75 Allowed 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER 143.41 125.55 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.911 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -54.65 -53.86 49.23 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 0.0 109.551 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.462 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 5.1 mp0 -48.54 -20.22 0.41 Allowed 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.2 -0.938 . . . . 0.0 109.79 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.584 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -71.77 -34.01 69.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.195 -0.94 . . . . 0.0 109.225 179.655 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.592 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -56.03 -40.12 73.0 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.433 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.475 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.3 mt -58.74 -55.08 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.902 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -73.27 7.15 2.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.013 -1.055 . . . . 0.0 108.361 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.585 ' O ' HG23 ' A' ' 53' ' ' THR . 9.1 mm100 -116.07 -75.73 0.58 Allowed 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.17 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.552 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 2.5 m -65.82 48.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.125 -0.984 . . . . 0.0 109.496 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 51' ' ' GLN . 0.7 OUTLIER -73.75 172.5 11.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.181 -0.949 . . . . 0.0 109.739 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.58 ' OD1' ' N ' ' A' ' 55' ' ' ASP . 1.1 p30 -55.27 -48.27 74.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.273 -0.892 . . . . 0.0 109.763 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.58 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.5 OUTLIER -76.28 42.21 0.26 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 -179.874 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.561 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 96.0 t -148.19 147.18 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 109.836 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -138.38 120.91 16.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.404 -0.81 . . . . 0.0 109.516 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.748 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.5 pp -172.86 175.97 3.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.076 -1.015 . . . . 0.0 110.462 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.624 ' O ' HG22 ' A' ' 28' ' ' THR . 3.9 m-85 -104.46 152.03 22.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.984 -1.072 . . . . 0.0 108.807 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.441 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.43 152.04 51.87 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.965 -1.085 . . . . 0.0 109.017 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.461 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 39.5 t80 -150.82 96.93 2.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.076 . . . . 0.0 109.498 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.55 154.89 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.248 -0.907 . . . . 0.0 108.949 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -80.7 113.29 18.79 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.359 -0.838 . . . . 0.0 108.983 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.546 ' CE2' ' HB3' ' A' ' 77' ' ' ALA . 12.5 m-85 -93.87 155.8 16.99 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.88 . . . . 0.0 109.661 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.97 149.62 34.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.164 -0.96 . . . . 0.0 108.97 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 90.5 m . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.438 -0.789 . . . . 0.0 109.473 179.903 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.616 ' HG2' HD22 ' A' ' 129' ' ' LEU . 0.6 OUTLIER -104.74 157.69 17.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.393 -0.817 . . . . 0.0 109.89 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -133.26 119.73 20.18 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.458 -0.776 . . . . 0.0 109.054 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.698 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -144.09 156.8 44.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.091 -1.006 . . . . 0.0 110.947 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.6 tt -106.57 157.29 17.79 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.55 HG23 HD11 ' A' ' 114' ' ' ILE . 36.9 mt -137.36 133.26 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 120.92 -1.113 . . . . 0.0 109.066 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.44 HG23 ' CD2' ' A' ' 59' ' ' PHE . 1.3 m -95.72 117.76 31.12 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.165 -0.959 . . . . 0.0 109.653 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.561 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -93.02 110.38 21.85 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.089 -1.007 . . . . 0.0 109.729 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -105.21 93.01 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -58.09 156.35 19.76 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.524 ' O ' ' N ' ' A' ' 86' ' ' VAL . 2.9 mm-40 -78.72 -51.47 9.76 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -1.163 . . . . 0.0 109.63 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -67.0 39.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.183 -0.948 . . . . 0.0 109.57 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.524 ' N ' ' O ' ' A' ' 84' ' ' GLU . 92.8 t -96.63 157.3 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.23 -0.919 . . . . 0.0 109.725 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.434 ' N ' HG12 ' A' ' 86' ' ' VAL . 9.2 p -99.38 -161.49 0.88 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.324 -0.86 . . . . 0.0 109.461 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.03 -15.97 68.54 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.8 mp -46.93 -54.27 10.44 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.073 -1.251 . . . . 0.0 109.408 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.685 ' NE2' ' N ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -57.29 -35.16 69.46 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.865 . . . . 0.0 109.165 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.685 ' N ' ' NE2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -47.6 -62.72 1.31 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.061 -1.024 . . . . 0.0 109.961 -179.358 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.09 -40.52 19.72 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.13 -0.981 . . . . 0.0 110.132 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.444 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 56.8 mmtt -61.66 -59.05 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 0.0 110.312 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.638 HG23 ' OH ' ' A' ' 31' ' ' TYR . 27.3 m -55.78 -49.09 74.1 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.962 -1.086 . . . . 0.0 109.516 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.47 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.87 -62.12 2.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.7 p -64.91 -49.26 71.11 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.118 -1.225 . . . . 0.0 111.104 -178.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.671 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.3 OUTLIER -66.85 -42.18 86.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.914 -1.116 . . . . 0.0 111.401 -177.824 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -22.64 63.55 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.623 -1.298 . . . . 0.0 109.201 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -82.3 -21.47 36.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.368 -0.833 . . . . 0.0 108.812 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.4 mt -83.46 -61.94 1.71 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.397 -0.815 . . . . 0.0 109.272 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.614 HG13 ' N ' ' A' ' 102' ' ' LYS . 8.6 p -46.78 -46.85 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.743 ' HD3' ' OE2' ' A' ' 111' ' ' GLU . 3.3 ttmt -66.31 -44.29 83.82 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.232 -0.918 . . . . 0.0 109.615 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -47.98 -68.53 0.18 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.221 -0.925 . . . . 0.0 110.153 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.682 HG21 ' HD3' ' A' ' 7' ' ' LYS . 14.5 p -74.16 42.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -0.947 . . . . 0.0 110.05 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -121.0 167.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.417 -0.802 . . . . 0.0 109.712 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.577 ' C ' ' H ' ' A' ' 108' ' ' PHE . 3.1 pt20 -177.21 -29.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.671 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 1.3 m-20 -66.77 26.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.528 -0.732 . . . . 0.0 109.738 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.577 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -139.82 154.29 47.31 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.0 109.478 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.43 -31.98 14.4 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.476 -0.765 . . . . 0.0 109.778 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -162.35 152.37 16.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.743 ' OE2' ' HD3' ' A' ' 102' ' ' LYS . 7.8 pt-20 -104.87 156.9 17.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.894 . . . . 0.0 108.682 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -142.28 158.35 43.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.943 -1.098 . . . . 0.0 110.894 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.764 ' O ' HD13 ' A' ' 114' ' ' ILE . 4.1 p -117.01 158.12 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.764 HD13 ' O ' ' A' ' 113' ' ' VAL . 4.4 mm -138.07 154.5 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.083 -1.011 . . . . 0.0 110.314 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.63 -0.12 2.92 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.487 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -155.08 155.35 33.92 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.381 -0.824 . . . . 0.0 109.072 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -74.39 -24.75 59.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.005 . . . . 0.0 109.912 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.528 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 1.0 OUTLIER -68.82 -14.52 63.08 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.135 -0.978 . . . . 0.0 109.144 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.585 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 10.2 mm-40 -87.09 4.1 43.51 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.767 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.673 HD23 HD11 ' A' ' 125' ' ' ILE . 9.2 mt -107.18 31.17 5.57 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.278 -0.889 . . . . 0.0 109.577 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 118' ' ' LYS . 1.6 mt-10 -79.27 138.08 37.63 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.044 -1.035 . . . . 0.0 109.903 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -46.0 -53.75 9.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.095 -1.003 . . . . 0.0 109.477 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . 0.733 ' OD1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -60.78 -38.6 85.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.277 -0.89 . . . . 0.0 109.735 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.585 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 20.8 t80 -61.06 -48.18 82.94 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.208 -0.932 . . . . 0.0 109.157 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.673 HD11 HD23 ' A' ' 120' ' ' LEU . 2.0 mm -58.96 -21.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.562 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -82.24 -44.97 15.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.129 -0.982 . . . . 0.0 109.838 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.7 t -58.33 -30.94 67.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.246 -0.909 . . . . 0.0 109.842 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -85.24 -38.93 18.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.582 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.698 HD21 ' HB2' ' A' ' 77' ' ' ALA . 6.1 mt -68.2 -27.82 66.72 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.122 -0.986 . . . . 0.0 109.295 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.3 mttp . . . . . 0 N--CA 1.488 1.474 0 O-C-N 121.172 -0.955 . . . . 0.0 109.106 179.711 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.63 ' CB ' HG23 ' A' ' 35' ' ' THR . 23.1 mttp -128.77 124.06 34.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.466 -0.771 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.597 HD12 HG21 ' A' ' 36' ' ' ILE . 3.0 tp -107.59 130.32 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.379 -0.825 . . . . 0.0 109.476 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -102.86 60.89 0.79 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.148 -0.97 . . . . 0.0 109.451 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.711 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -45.52 -14.11 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.065 -1.022 . . . . 0.0 109.51 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 6' ' ' ASP . 4.0 mt-10 -55.53 -50.74 69.19 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.199 -0.938 . . . . 0.0 109.443 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.29 -58.19 6.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 109.383 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.596 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.3 m -57.05 -65.17 0.66 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 109.776 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.586 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 9.7 tmm_? -44.62 -57.68 3.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.981 -1.075 . . . . 0.0 109.959 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.64 -33.05 53.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.169 -0.957 . . . . 0.0 109.366 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.2 -39.69 25.03 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.75 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.667 ' CZ ' ' CG ' ' A' ' 61' ' ' PHE . 1.5 m-85 -50.27 -49.23 53.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.23 -0.919 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.738 ' H ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -80.13 -17.42 52.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.099 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 16' ' ' LEU . 33.1 tp -70.61 -22.72 62.51 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.733 HG11 ' O ' ' A' ' 25' ' ' ILE . 4.5 m -92.0 -3.09 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.91 . . . . 0.0 109.529 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.653 HH11 ' CG ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.317 -0.865 . . . . 0.0 109.382 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.569 0.7 . . . . 0.0 110.405 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 24' ' ' VAL . 2.4 m -39.18 123.53 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.512 -0.742 . . . . 0.0 110.494 -179.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.733 ' O ' HG11 ' A' ' 17' ' ' VAL . 0.3 OUTLIER -63.09 -55.0 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.694 ' CE3' HG23 ' A' ' 28' ' ' THR . 17.7 p-90 -128.86 165.13 21.61 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.579 ' CG1' HG21 ' A' ' 24' ' ' VAL . 27.8 m -133.48 133.52 57.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.24 -0.912 . . . . 0.0 109.278 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.694 HG23 ' CE3' ' A' ' 26' ' ' TRP . 72.5 p -125.87 137.83 53.76 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.283 -0.885 . . . . 0.0 109.65 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.657 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.65 163.56 16.27 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 178.475 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.675 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -141.0 142.22 34.27 Favored 'General case' 0 C--N 1.294 -1.831 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.538 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.417 ' C ' ' O ' ' A' ' 30' ' ' ARG . 6.6 m-85 -42.76 98.55 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.486 -0.759 . . . . 0.0 109.887 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 30' ' ' ARG . 1.3 t0 -97.97 101.59 13.12 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 57.68 -120.18 20.12 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.076 -1.61 . . . . 0.0 109.076 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.67 22.94 15.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -1.06 . . . . 0.0 110.292 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.63 HG23 ' CB ' ' A' ' 4' ' ' LYS . 2.8 m -143.47 134.95 26.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.107 -0.996 . . . . 0.0 110.014 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.597 HG21 HD12 ' A' ' 5' ' ' ILE . 1.6 mp -84.44 110.27 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.302 -0.874 . . . . 0.0 108.969 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 m -135.8 158.58 73.78 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.277 -0.889 . . . . 0.0 109.662 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -50.74 135.78 42.23 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.754 2.303 . . . . 0.0 111.585 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.465 ' HA3' HH11 ' A' ' 30' ' ' ARG . . . -130.4 -22.96 1.04 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.608 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.8 m-20 -142.68 -178.35 5.74 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.492 -1.005 . . . . 0.0 109.425 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.905 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -163.22 -176.99 5.1 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.435 -0.79 . . . . 0.0 109.764 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.407 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -157.27 141.92 8.23 Favored Glycine 0 N--CA 1.489 2.174 0 C-N-CA 119.549 -1.31 . . . . 0.0 109.9 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.3 -8.8 18.03 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -157.52 174.83 14.78 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.574 ' CZ ' ' CE2' ' A' ' 48' ' ' PHE . 31.0 t80 -73.68 -10.64 59.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.277 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.631 ' HA ' HD11 ' A' ' 49' ' ' ILE . 46.0 mm-40 -75.61 -30.29 59.51 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.187 -0.946 . . . . 0.0 110.636 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.533 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -79.36 -4.0 48.87 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.609 -1.307 . . . . 0.0 110.044 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.583 ' CZ ' HD13 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -83.13 -51.51 7.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.835 -1.166 . . . . 0.0 110.193 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.756 HD12 ' N ' ' A' ' 49' ' ' ILE . 0.1 OUTLIER -63.03 -32.66 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 120.876 -1.14 . . . . 0.0 109.137 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.93 -21.5 60.87 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.608 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.0 OUTLIER -96.46 -15.1 21.92 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.527 -179.187 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.565 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 7.5 m -117.92 52.44 1.0 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.414 -0.804 . . . . 0.0 110.228 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 55' ' ' ASP . 23.3 p -72.48 166.87 21.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.911 -1.118 . . . . 0.0 109.266 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -70.47 12.21 0.27 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 109.768 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 53' ' ' THR . 5.9 m-20 -120.49 24.82 10.15 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.398 -0.814 . . . . 0.0 109.749 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.438 HG13 ' CD1' ' A' ' 81' ' ' TRP . 6.8 p -148.11 162.79 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.577 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.487 ' O ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -138.38 126.09 22.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.261 -0.899 . . . . 0.0 110.178 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.743 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.0 pp -172.85 173.81 3.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.165 -0.96 . . . . 0.0 110.0 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.56 ' O ' HG22 ' A' ' 28' ' ' THR . 0.6 OUTLIER -107.19 154.52 21.08 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.22 -0.925 . . . . 0.0 108.739 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.483 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -134.74 157.53 46.47 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.166 -0.959 . . . . 0.0 109.458 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.667 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 85.8 t80 -149.85 96.6 2.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.269 -0.895 . . . . 0.0 109.27 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.5 158.12 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.253 -0.904 . . . . 0.0 109.305 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -84.39 127.25 33.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.194 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -104.22 155.93 18.32 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 109.761 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.8 m -79.78 143.35 34.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.355 -0.841 . . . . 0.0 109.108 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.8 m . . . . . 0 N--CA 1.491 1.579 0 O-C-N 121.457 -0.777 . . . . 0.0 109.362 179.868 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.34 152.46 28.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.355 -0.84 . . . . 0.0 109.44 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.667 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 1.7 m-85 -134.17 126.46 29.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.411 -0.806 . . . . 0.0 109.683 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.64 159.32 43.0 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.794 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.572 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -113.08 155.84 24.19 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 120' ' ' LEU . 2.0 mt -138.06 135.68 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.915 -1.116 . . . . 0.0 109.121 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.3 m -95.93 120.24 35.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.565 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 64.9 t-105 -92.86 111.32 22.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.028 -1.045 . . . . 0.0 109.878 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -107.52 92.88 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.505 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -61.64 147.36 48.15 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.19 -14.1 60.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.31 -1.112 . . . . 0.0 109.582 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.59 37.02 1.41 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 109.492 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 83' ' ' GLY . 43.6 t -102.79 160.47 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.477 ' N ' HG12 ' A' ' 86' ' ' VAL . 14.0 m -91.64 -170.29 2.55 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.373 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -18.1 64.07 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 90' ' ' GLN . 8.0 mt -51.08 -69.79 0.1 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.15 -1.206 . . . . 0.0 109.5 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.552 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 0.9 OUTLIER -44.61 -33.94 1.98 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 109.292 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.45 ' HA ' ' HE ' ' A' ' 91' ' ' ARG . 1.1 tpm_? -45.62 -61.69 1.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.693 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.7 -37.24 42.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.193 -0.942 . . . . 0.0 109.487 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.413 ' O ' ' C ' ' A' ' 94' ' ' THR . 0.1 OUTLIER -64.75 -66.31 0.56 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.943 . . . . 0.0 109.834 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.499 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 95.6 m -44.74 -40.68 6.22 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.25 -0.906 . . . . 0.0 109.562 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.489 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -51.12 -57.22 11.68 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 35.0 p -67.92 -47.99 67.2 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.957 -1.32 . . . . 0.0 110.909 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.59 ' OD2' HD13 ' A' ' 36' ' ' ILE . 9.6 t0 -69.66 -45.37 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.816 -1.177 . . . . 0.0 111.03 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.499 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -55.38 -24.26 28.87 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.774 -1.17 . . . . 0.0 108.604 -179.734 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.3 OUTLIER -67.23 -50.24 61.43 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.338 -0.851 . . . . 0.0 108.79 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 100' ' ' LEU . 10.4 mp -51.33 -54.67 24.01 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.292 -0.88 . . . . 0.0 109.499 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.467 HG22 HD11 ' A' ' 5' ' ' ILE . 31.2 t -48.94 -74.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.148 -0.97 . . . . 0.0 109.945 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 101' ' ' VAL . 32.8 mtmt -43.13 -48.96 6.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.152 -0.968 . . . . 0.0 109.681 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.58 -57.37 12.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.921 . . . . 0.0 110.045 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.783 HG12 ' O ' ' A' ' 104' ' ' VAL . 97.5 t -75.56 40.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 109.911 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.461 HG12 ' O ' ' A' ' 105' ' ' VAL . 2.2 t -138.23 113.04 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.098 -1.001 . . . . 0.0 109.863 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.621 ' O ' ' N ' ' A' ' 108' ' ' PHE . 1.0 OUTLIER -124.2 -30.24 3.47 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 9.3 m-20 -61.21 35.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.822 -0.549 . . . . 0.0 110.214 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.621 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -149.71 -178.06 6.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.066 -1.021 . . . . 0.0 110.135 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.96 -62.76 1.29 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.414 -0.804 . . . . 0.0 109.925 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.534 ' NZ ' ' CB ' ' A' ' 110' ' ' LYS . 5.6 ttpm? -147.4 173.9 12.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.22 -0.925 . . . . 0.0 109.6 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.489 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -104.62 155.43 18.85 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.932 . . . . 0.0 109.192 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -135.43 150.67 49.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.272 -0.893 . . . . 0.0 110.069 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.8 p -116.29 147.26 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 115' ' ' SER . 27.5 mm -138.5 156.56 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.188 -0.945 . . . . 0.0 110.375 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.403 ' O ' ' OG ' ' A' ' 115' ' ' SER . 0.3 OUTLIER -140.75 6.03 2.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.584 ' OD1' ' N ' ' A' ' 117' ' ' ARG . 43.3 t0 -150.14 155.36 39.67 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.866 . . . . 0.0 109.409 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.584 ' N ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -79.04 -28.39 43.23 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.197 -0.939 . . . . 0.0 110.047 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -73.99 -14.74 61.07 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.603 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -86.41 4.63 38.67 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -0.821 . . . . 0.0 109.744 -179.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.796 HD23 HD11 ' A' ' 125' ' ' ILE . 7.2 mt -114.12 29.48 7.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.362 -0.837 . . . . 0.0 109.652 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 122' ' ' GLU . 4.0 mm-40 -76.83 141.83 40.51 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.351 -0.843 . . . . 0.0 109.287 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 121' ' ' GLU . 1.3 mt-10 -41.31 -52.4 3.46 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.187 -0.945 . . . . 0.0 109.742 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.2 -10.88 45.81 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.307 -0.87 . . . . 0.0 110.868 -179.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.603 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 18.0 t80 -86.34 -48.81 8.15 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.737 -1.227 . . . . 0.0 109.359 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.796 HD11 HD23 ' A' ' 120' ' ' LEU . 4.1 mm -76.24 -20.56 15.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -73.34 -53.35 10.99 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.27 -0.894 . . . . 0.0 108.951 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.65 -18.66 65.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.315 -0.866 . . . . 0.0 109.315 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.404 ' CG ' ' O ' ' A' ' 124' ' ' PHE . 5.7 mm-40 -72.36 -43.09 64.53 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.191 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 9.1 mt -66.51 -36.39 82.59 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? . . . . . 0 C--N 1.303 -1.432 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.81 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 35' ' ' THR . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.724 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.621 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.578 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.801 HD22 HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.804 HG22 ' O ' ' A' ' 24' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.709 HG22 ' O ' ' A' ' 42' ' ' GLY . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.688 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.621 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.771 ' OH ' HG23 ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.544 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.709 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.446 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.591 ' O ' HG23 ' A' ' 53' ' ' THR . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.3 mm100 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.463 ' SG ' HD21 ' A' ' 120' ' ' LEU . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.521 ' H ' ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.553 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.825 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.633 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.825 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.714 ' HD3' HD13 ' A' ' 129' ' ' LEU . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.454 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.62 ' CG2' HD12 ' A' ' 114' ' ' ILE . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.441 HG23 ' CD2' ' A' ' 59' ' ' PHE . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 80' ' ' THR . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.525 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' THR . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.771 HG23 ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' ALA . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.415 ' OD2' HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 104' ' ' VAL . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.427 ' O ' HG12 ' A' ' 105' ' ' VAL . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.801 HD22 HD22 ' A' ' 15' ' ' ASN . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.62 HD12 ' CG2' ' A' ' 79' ' ' ILE . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.661 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.714 HD13 ' HD3' ' A' ' 75' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -139.61 118.44 12.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.236 -0.915 . . . . 0.0 109.47 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.506 HG23 ' HG3' ' A' ' 7' ' ' LYS . 1.3 tt -113.84 147.21 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.522 -0.736 . . . . 0.0 109.653 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -94.37 63.0 2.97 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.218 -0.926 . . . . 0.0 109.111 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.746 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.49 -26.16 60.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 109.55 -179.705 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.87 -46.6 71.36 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.278 -0.889 . . . . 0.0 109.407 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -60.86 -68.12 0.34 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.947 . . . . 0.0 109.582 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.76 -58.9 2.79 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.164 -0.96 . . . . 0.0 109.859 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 8.5 ttt180 -44.41 -59.57 2.35 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.925 -1.109 . . . . 0.0 110.219 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.75 -37.0 65.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.937 . . . . 0.0 110.038 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.483 ' CB ' HG11 ' A' ' 27' ' ' VAL . . . -83.6 -19.17 36.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.096 -1.003 . . . . 0.0 110.117 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.505 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -72.62 -53.89 10.62 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.111 -0.993 . . . . 0.0 109.569 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.715 ' ND2' HD22 ' A' ' 107' ' ' ASN . 1.7 m-80 -68.51 -25.68 65.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.221 -0.924 . . . . 0.0 109.547 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.3 tp -57.64 -61.33 2.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.233 -0.917 . . . . 0.0 109.329 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 14' ' ' TYR . 21.4 m -51.84 -19.41 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 109.733 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.169 -0.957 . . . . 0.0 109.507 -179.852 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.494 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.494 ' C ' ' O ' ' A' ' 23' ' ' ALA . 4.8 m 31.94 74.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.846 -0.534 . . . . 0.0 110.686 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.754 HG22 ' O ' ' A' ' 42' ' ' GLY . 6.3 tt -44.49 -38.4 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.089 -1.007 . . . . 0.0 108.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.753 ' CD1' HG23 ' A' ' 25' ' ' ILE . 43.5 p-90 -150.57 162.51 40.5 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.397 -0.814 . . . . 0.0 109.25 178.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.483 HG11 ' CB ' ' A' ' 13' ' ' ALA . 26.8 m -133.26 139.4 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 109.187 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.584 HG23 ' CE3' ' A' ' 26' ' ' TRP . 60.7 p -128.98 139.93 51.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.34 -0.85 . . . . 0.0 110.179 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.18 133.36 51.58 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 16.9 ptt180 -108.59 147.41 31.85 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.852 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.475 ' HH ' ' CG ' ' A' ' 97' ' ' ASP . 14.5 m-85 -47.55 98.66 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.565 -0.709 . . . . 0.0 109.766 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -96.02 101.97 13.7 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.7 -120.23 21.47 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.99 22.25 16.23 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.326 -1.103 . . . . 0.0 110.228 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.0 m -145.33 136.99 25.35 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.805 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.9 mp -81.62 114.35 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.221 -0.924 . . . . 0.0 108.979 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -135.46 152.0 75.7 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 109.717 -179.56 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 97.0 Cg_exo -33.12 145.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 122.971 2.447 . . . . 0.0 112.252 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -137.44 -36.45 0.17 Allowed Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.653 ' CG ' HE22 ' A' ' 51' ' ' GLN . 2.7 m-20 -142.67 -179.81 6.54 Favored 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.731 -0.864 . . . . 0.0 109.419 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.848 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -157.03 179.8 8.94 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.995 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.754 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.27 133.09 2.89 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.45 -3.04 24.52 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.82 175.97 12.92 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -42.42 70.55 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 120.677 -1.264 . . . . 0.0 108.946 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.489 ' NE2' ' N ' ' A' ' 46' ' ' GLN . 0.7 OUTLIER -43.09 -35.54 1.34 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.305 -0.872 . . . . 0.0 110.674 -179.328 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.536 ' CE1' ' OE1' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -62.95 -22.56 66.88 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.013 -1.054 . . . . 0.0 109.532 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.553 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -68.44 -23.97 64.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.202 -0.936 . . . . 0.0 108.718 179.489 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.522 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.4 mt -76.57 -54.02 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.582 -0.699 . . . . 0.0 109.927 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.455 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -65.56 -2.94 3.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 179.413 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.653 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.1 mm100 -106.13 -37.54 6.56 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.11 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.595 ' O ' HG23 ' A' ' 53' ' ' THR . 0.1 OUTLIER -49.32 132.43 20.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.287 -0.883 . . . . 0.0 109.644 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.595 HG23 ' O ' ' A' ' 52' ' ' CYS . 20.6 p -160.07 115.29 2.34 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.4 -0.813 . . . . 0.0 110.555 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.74 11.36 0.1 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.628 -0.67 . . . . 0.0 109.587 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.538 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -122.71 16.68 10.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.495 -0.753 . . . . 0.0 109.324 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.532 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -135.72 154.26 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.4 -0.813 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.728 ' H ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.59 131.73 43.52 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.355 -0.841 . . . . 0.0 109.519 -179.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.765 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.8 pp -172.69 172.39 4.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.974 -1.078 . . . . 0.0 110.317 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.567 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 2.2 m-85 -106.01 153.96 21.29 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -135.83 156.9 48.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.02 -1.05 . . . . 0.0 109.556 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 53.9 t80 -148.19 97.57 2.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.358 -0.839 . . . . 0.0 109.21 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.503 ' O ' ' CE1' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -115.74 150.97 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -80.47 108.6 14.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.276 -0.89 . . . . 0.0 108.96 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CE1' ' O ' ' A' ' 62' ' ' VAL . 14.9 m-85 -86.72 155.76 20.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.324 -0.86 . . . . 0.0 109.805 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.55 161.04 28.19 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.298 -0.876 . . . . 0.0 108.848 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 0.0 109.466 -179.902 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.647 ' HD2' HD22 ' A' ' 129' ' ' LEU . 2.6 mmtp -104.59 154.98 19.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.846 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.582 ' O ' ' N ' ' A' ' 109' ' ' ALA . 84.3 m-85 -133.22 118.8 19.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.151 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.426 ' HB1' ' O ' ' A' ' 110' ' ' LYS . . . -144.36 167.18 23.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.139 -0.976 . . . . 0.0 111.024 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.436 ' HG ' ' N ' ' A' ' 79' ' ' ILE . 9.2 tp -111.87 151.64 28.87 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.568 HG23 HG12 ' A' ' 114' ' ' ILE . 22.1 mt -130.35 129.54 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.99 -1.069 . . . . 0.0 108.758 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.476 HG22 HD11 ' A' ' 82' ' ' ILE . 5.7 m -95.86 115.05 26.86 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.532 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 62.8 t-105 -92.97 111.23 22.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.101 -0.999 . . . . 0.0 109.651 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.476 HD11 HG22 ' A' ' 80' ' ' THR . 24.9 mm -104.1 93.19 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 108.906 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.59 137.6 39.7 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -79.55 53.22 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.286 -1.126 . . . . 0.0 109.653 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -141.22 -30.99 0.6 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.17 -0.956 . . . . 0.0 109.81 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.463 HG21 ' NE2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -64.83 156.81 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.188 -0.945 . . . . 0.0 109.623 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.453 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 54.9 p -96.04 -127.89 0.14 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.363 -0.836 . . . . 0.0 109.587 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.453 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.17 -18.33 63.01 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.53 ' O ' ' CG ' ' A' ' 93' ' ' LYS . 3.4 mt -46.14 -48.9 17.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.971 -1.311 . . . . 0.0 109.934 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.463 ' NE2' HG21 ' A' ' 86' ' ' VAL . 3.1 pt20 -66.03 -26.39 67.49 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.145 -0.972 . . . . 0.0 109.908 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -56.39 -67.2 0.32 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.966 -1.084 . . . . 0.0 110.188 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.77 -44.43 49.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.18 -0.95 . . . . 0.0 110.131 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 89' ' ' LEU . 12.3 mmtm -55.82 -65.19 0.64 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.208 -0.933 . . . . 0.0 110.102 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 8.0 m -50.78 -49.68 57.75 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.131 -0.981 . . . . 0.0 109.679 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -46.94 -61.1 4.58 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 m -63.91 -51.12 65.94 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.031 -1.276 . . . . 0.0 111.78 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -74.57 -39.76 62.07 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.725 -1.234 . . . . 0.0 111.784 -177.183 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.588 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -55.36 -26.36 40.65 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 120.585 -1.322 . . . . 0.0 108.642 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.45 -30.34 47.42 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 97' ' ' ASP . 2.0 mt -71.18 -64.57 0.89 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.439 -0.788 . . . . 0.0 109.339 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.603 HG13 ' N ' ' A' ' 102' ' ' LYS . 9.9 p -41.9 -45.46 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.209 -0.932 . . . . 0.0 110.008 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.603 ' N ' HG13 ' A' ' 101' ' ' VAL . 6.1 ttpt -65.99 -39.4 90.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.271 -0.893 . . . . 0.0 109.597 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.66 -51.27 70.11 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.251 -0.906 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.639 HG12 ' O ' ' A' ' 104' ' ' VAL . 40.2 t -77.64 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.099 -1.001 . . . . 0.0 109.954 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.507 HG12 ' O ' ' A' ' 102' ' ' LYS . 1.7 p -112.57 136.55 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.338 -0.851 . . . . 0.0 109.513 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -145.65 24.67 1.36 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.373 -0.829 . . . . 0.0 108.928 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.715 HD22 ' ND2' ' A' ' 15' ' ' ASN . 2.8 t-20 -135.39 -25.32 1.33 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.432 -0.792 . . . . 0.0 110.141 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -76.86 171.1 15.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.388 -179.561 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -117.79 -31.74 5.04 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.77 ' HE2' ' CE1' ' A' ' 112' ' ' PHE . 3.2 ttpm? -162.46 152.05 15.89 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.507 -0.746 . . . . 0.0 109.16 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -104.43 155.45 18.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.127 -0.983 . . . . 0.0 109.088 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.77 ' CE1' ' HE2' ' A' ' 110' ' ' LYS . 9.4 m-85 -133.88 156.44 48.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.366 -0.834 . . . . 0.0 109.819 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.765 ' O ' HG13 ' A' ' 113' ' ' VAL . 13.0 p -113.44 97.41 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.695 HG23 ' HB3' ' A' ' 119' ' ' GLU . 30.4 mm -100.32 142.44 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.228 -0.92 . . . . 0.0 109.888 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.1 m -141.1 15.6 2.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.308 -0.87 . . . . 0.0 109.548 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.9 155.34 46.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.034 -1.041 . . . . 0.0 110.124 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -69.71 -36.25 75.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 109.709 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -76.3 -17.36 59.48 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.695 ' HB3' HG23 ' A' ' 114' ' ' ILE . 15.3 mm-40 -83.25 -15.84 48.71 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.475 ' HG ' HG21 ' A' ' 114' ' ' ILE . 0.5 OUTLIER -103.44 30.95 4.62 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.736 ' CG ' ' H ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -74.54 -175.31 2.35 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.448 0.642 . . . . 0.0 110.367 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.476 ' C ' ' OE2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -84.06 -44.65 13.88 Favored 'General case' 0 C--N 1.295 -1.771 0 O-C-N 121.36 -0.838 . . . . 0.0 110.145 177.272 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -85.79 -44.89 12.11 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 114.884 1.438 . . . . 0.0 114.884 -175.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.736 ' H ' ' CG ' ' A' ' 121' ' ' GLU . 18.9 t80 -49.94 -40.79 44.79 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 119.874 -1.766 . . . . 0.0 108.93 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.573 ' H ' ' CD ' ' A' ' 121' ' ' GLU . 1.1 mm -78.21 -27.17 14.53 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.831 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -67.48 -45.66 75.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.981 -1.074 . . . . 0.0 109.719 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . 0.534 ' O ' ' N ' ' A' ' 130' ' ' LYS . 0.8 OUTLIER -63.2 -66.51 0.53 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.488 ' CD ' ' CE2' ' A' ' 112' ' ' PHE . 24.0 pt-20 -41.97 -33.2 0.52 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.489 -0.757 . . . . 0.0 109.318 -178.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.647 HD22 ' HD2' ' A' ' 75' ' ' LYS . 4.8 mt -79.08 -32.17 44.64 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.111 -0.993 . . . . 0.0 109.056 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.534 ' N ' ' O ' ' A' ' 127' ' ' SER . 14.2 mttp . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.261 -0.9 . . . . 0.0 108.951 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.412 ' CG2' ' OD2' ' A' ' 97' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.475 ' CB ' HG23 ' A' ' 35' ' ' THR . 11.0 mmtm -133.49 121.79 22.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.38 -0.825 . . . . 0.0 109.314 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.461 HG23 ' H ' ' A' ' 7' ' ' LYS . 2.2 tp -107.44 136.18 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.408 -0.807 . . . . 0.0 109.747 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 8' ' ' GLU . 1.9 p-10 -97.84 41.84 1.11 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -0.891 . . . . 0.0 109.041 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.652 ' NZ ' HG13 ' A' ' 101' ' ' VAL . 1.3 mmtm -42.01 -18.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.346 -0.846 . . . . 0.0 109.898 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.5 mt-10 -51.96 -35.65 46.83 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.201 -0.937 . . . . 0.0 109.484 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.411 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -75.81 -63.67 1.25 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.863 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.65 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.49 -57.96 3.26 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.09 -1.006 . . . . 0.0 109.888 -179.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.65 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -44.16 -59.58 2.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.997 -1.064 . . . . 0.0 110.001 -179.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.9 -37.22 71.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.128 -0.983 . . . . 0.0 109.632 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.452 ' CB ' HG11 ' A' ' 27' ' ' VAL . . . -81.13 -11.13 59.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.12 -0.988 . . . . 0.0 109.852 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.476 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -81.88 -51.85 7.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.11 -0.994 . . . . 0.0 109.734 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.618 ' H ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -77.72 -11.25 59.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.247 -0.908 . . . . 0.0 109.64 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.479 ' C ' ' H ' ' A' ' 18' ' ' ARG . 58.3 tp -78.41 -50.06 12.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.207 -0.933 . . . . 0.0 109.34 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 m -57.87 -2.87 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.306 -0.871 . . . . 0.0 109.484 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.479 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.816 ' O ' HG12 ' A' ' 24' ' ' VAL . 55.7 t 53.02 57.16 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.269 -0.894 . . . . 0.0 109.482 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.79 HG23 ' CD1' ' A' ' 26' ' ' TRP . 6.9 tt -47.16 -36.45 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.906 -1.121 . . . . 0.0 108.865 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.79 ' CD1' HG23 ' A' ' 25' ' ' ILE . 57.9 p-90 -148.27 151.57 35.66 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.784 -1.197 . . . . 0.0 109.671 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.452 HG11 ' CB ' ' A' ' 13' ' ' ALA . 2.4 m -112.35 163.36 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.31 -0.869 . . . . 0.0 109.701 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.463 HG22 HD23 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -145.47 129.37 17.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.177 -0.952 . . . . 0.0 110.482 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.97 119.66 27.21 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 25.0 ptt180 -101.73 144.83 29.94 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -48.44 98.55 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.532 -0.73 . . . . 0.0 109.753 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -92.67 101.95 14.36 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.95 -119.28 15.55 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.094 -1.603 . . . . 0.0 109.094 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.34 24.95 12.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.546 -0.973 . . . . 0.0 110.146 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.475 HG23 ' CB ' ' A' ' 4' ' ' LYS . 11.4 m -146.36 132.59 19.46 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.151 -0.968 . . . . 0.0 109.982 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.741 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.5 mp -79.95 113.12 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.175 -0.953 . . . . 0.0 108.515 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.46 152.13 75.92 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.196 -0.94 . . . . 0.0 110.16 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_exo -34.78 141.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.903 2.402 . . . . 0.0 112.471 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.78 -37.88 0.28 Allowed Glycine 0 N--CA 1.488 2.167 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -143.54 -179.49 6.47 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.661 ' CD ' ' H ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -130.79 -165.32 1.54 Allowed 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 121.49 0.662 . . . . 0.0 109.92 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.725 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -139.36 101.61 0.32 Allowed Glycine 0 C--N 1.299 -1.497 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.531 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -136.9 50.99 1.99 Allowed 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.531 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 3.6 m-20 155.63 106.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.68 ' OH ' ' HE1' ' A' ' 64' ' ' PHE . 23.0 t80 -53.78 -14.69 1.0 Allowed 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.403 ' N ' ' C ' ' A' ' 44' ' ' ASP . 43.5 mm-40 -85.15 -40.73 16.4 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.012 -1.055 . . . . 0.0 109.893 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.4 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -61.66 -37.15 82.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.872 . . . . 0.0 110.334 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.623 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -59.12 -47.68 84.37 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.849 -1.157 . . . . 0.0 108.468 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.53 ' N ' ' CG ' ' A' ' 48' ' ' PHE . 1.7 mt -47.09 -43.72 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.396 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.9 pp0? -85.77 -10.06 56.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.95 -1.094 . . . . 0.0 110.481 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -86.95 8.15 24.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.96 -1.088 . . . . 0.0 109.771 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.581 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 4.8 p -130.7 55.09 1.85 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.341 -0.849 . . . . 0.0 109.477 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.554 ' C ' ' H ' ' A' ' 55' ' ' ASP . 9.5 p -73.45 159.48 33.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -0.945 . . . . 0.0 109.854 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.17 8.72 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.835 . . . . 0.0 110.156 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.554 ' H ' ' C ' ' A' ' 53' ' ' THR . 44.4 m-20 -116.84 21.8 13.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 109.57 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.524 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.2 OUTLIER -144.7 157.69 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.209 -0.932 . . . . 0.0 109.772 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.664 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -136.23 116.44 13.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.403 -0.81 . . . . 0.0 109.225 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.692 HD22 ' C ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -159.68 175.47 13.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.961 -1.087 . . . . 0.0 111.125 -179.357 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.709 ' HB3' HD11 ' A' ' 78' ' ' LEU . 3.5 m-85 -109.84 151.4 27.07 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.899 ' O ' HD12 ' A' ' 78' ' ' LEU . . . -134.37 154.61 51.26 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.896 -1.128 . . . . 0.0 109.349 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.442 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 47.3 t80 -148.8 99.14 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.076 -1.015 . . . . 0.0 108.926 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -118.86 152.66 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.382 -0.824 . . . . 0.0 108.976 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.476 HH11 ' HG3' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -84.47 123.37 30.19 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.403 -0.811 . . . . 0.0 109.053 179.461 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.68 ' HE1' ' OH ' ' A' ' 45' ' ' TYR . 94.1 m-85 -108.14 156.23 19.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.415 -0.803 . . . . 0.0 109.356 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.505 HG22 ' N ' ' A' ' 66' ' ' THR . 98.2 m -78.49 161.01 27.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.153 -0.967 . . . . 0.0 109.12 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.505 ' N ' HG22 ' A' ' 65' ' ' THR . 13.6 t . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.383 -0.823 . . . . 0.0 109.454 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.643 ' HD2' HD22 ' A' ' 129' ' ' LEU . 5.0 mmtm -105.86 143.62 33.75 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.325 -0.859 . . . . 0.0 109.71 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.419 ' O ' ' N ' ' A' ' 109' ' ' ALA . 90.9 m-85 -133.53 117.74 17.48 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.362 -0.836 . . . . 0.0 109.121 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.571 ' HB1' ' O ' ' A' ' 110' ' ' LYS . . . -144.38 167.74 21.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.018 -1.051 . . . . 0.0 111.3 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.899 HD12 ' O ' ' A' ' 60' ' ' ALA . 25.1 tp -114.16 156.48 24.16 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.497 HD11 HD12 ' A' ' 125' ' ' ILE . 6.6 mt -136.23 130.85 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.101 -0.999 . . . . 0.0 108.924 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.542 HG22 HD11 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -95.84 114.58 26.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.186 -0.946 . . . . 0.0 109.84 -179.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.673 ' C ' HD13 ' A' ' 82' ' ' ILE . 65.5 t-105 -93.35 112.38 24.28 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.579 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.673 HD13 ' C ' ' A' ' 81' ' ' TRP . 0.9 OUTLIER -114.81 93.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.463 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -48.21 156.39 1.12 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.54 -7.39 38.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -1.14 . . . . 0.0 109.698 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -102.9 21.11 16.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.227 -0.921 . . . . 0.0 109.583 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.878 HG12 ' H ' ' A' ' 87' ' ' SER . 4.8 t -86.28 -141.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.255 -0.903 . . . . 0.0 109.467 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.878 ' H ' HG12 ' A' ' 86' ' ' VAL . 10.0 m -150.27 -146.45 0.2 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.164 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.468 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -83.92 -17.28 65.76 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 90' ' ' GLN . 6.1 mp -46.5 -69.88 0.12 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.178 -1.189 . . . . 0.0 109.802 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.566 ' OE1' ' N ' ' A' ' 90' ' ' GLN . 3.3 mp0 -44.55 -29.65 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.121 -0.987 . . . . 0.0 109.229 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.468 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER -54.37 -64.5 0.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.12 -0.987 . . . . 0.0 109.737 -179.659 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 -44.11 38.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.161 -0.962 . . . . 0.0 109.707 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.35 -65.95 0.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.227 -0.921 . . . . 0.0 110.069 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.406 ' CB ' ' O ' ' A' ' 90' ' ' GLN . 2.1 m -51.86 -54.44 29.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.155 -0.966 . . . . 0.0 109.216 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.41 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.96 -62.84 2.5 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 p -64.58 -50.32 67.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.184 -1.186 . . . . 0.0 111.164 -178.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.435 ' HA ' HD12 ' A' ' 100' ' ' LEU . 2.9 m-20 -66.46 -40.2 89.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.782 -1.199 . . . . 0.0 111.693 -177.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.62 -24.52 65.57 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 120.628 -1.295 . . . . 0.0 109.119 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -77.69 -39.42 44.82 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' A' ' 101' ' ' VAL . 11.6 mt -64.38 -61.46 2.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.404 -0.81 . . . . 0.0 109.044 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.652 HG13 ' NZ ' ' A' ' 7' ' ' LYS . 42.7 t -38.88 -55.83 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 110.262 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 103' ' ' GLU . 76.9 tttt -65.39 -43.56 90.28 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.105 -0.997 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.425 ' C ' ' O ' ' A' ' 102' ' ' LYS . 1.4 tt0 -36.58 -33.64 0.05 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.487 -0.758 . . . . 0.0 111.293 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.755 HG22 ' O ' ' A' ' 104' ' ' VAL . 10.9 p -127.51 34.91 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.107 -0.996 . . . . 0.0 110.839 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.509 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 0.6 OUTLIER -115.07 119.9 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.93 . . . . 0.0 109.018 179.063 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.04 -27.58 1.82 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.248 -0.908 . . . . 0.0 109.388 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -51.89 -34.51 41.57 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.301 -0.874 . . . . 0.0 109.289 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.412 ' CE1' HG13 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -70.12 -176.49 1.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.156 -0.965 . . . . 0.0 109.782 179.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -125.01 -29.41 3.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.521 -0.737 . . . . 0.0 109.235 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 0.2 OUTLIER -159.16 140.69 13.19 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.0 109.348 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.655 ' H ' ' CD ' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -105.01 151.12 24.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.27 -0.894 . . . . 0.0 109.14 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -136.03 157.08 47.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.283 -0.886 . . . . 0.0 110.249 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.4 104.37 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.634 HG21 ' HG ' ' A' ' 120' ' ' LEU . 38.5 mm -97.83 151.43 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.184 -0.947 . . . . 0.0 109.816 -179.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.54 5.51 2.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.351 -0.843 . . . . 0.0 109.257 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -135.21 154.58 51.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.578 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -69.52 -42.37 74.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 109.739 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -75.59 -4.18 38.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.153 -0.967 . . . . 0.0 109.294 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.623 ' HB3' HG23 ' A' ' 114' ' ' ILE . 9.9 mm-40 -86.4 0.54 53.84 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.248 -0.907 . . . . 0.0 109.618 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.634 ' HG ' HG21 ' A' ' 114' ' ' ILE . 5.1 mt -104.84 14.58 29.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.278 -0.889 . . . . 0.0 109.041 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -68.71 140.48 55.4 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.496 -0.752 . . . . 0.0 109.675 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.37 -53.02 57.18 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.875 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.78 69.24 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.173 -0.955 . . . . 0.0 109.692 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CE1' ' OE2' ' A' ' 119' ' ' GLU . 78.8 t80 -63.15 -47.71 81.55 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 122.008 0.909 . . . . 0.0 108.977 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.497 HD12 HD11 ' A' ' 79' ' ' ILE . 1.3 mm -74.4 -23.59 18.33 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.58 -55.52 17.2 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.341 -0.85 . . . . 0.0 109.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -23.22 65.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.14 -39.75 17.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.643 HD22 ' HD2' ' A' ' 75' ' ' LYS . 2.8 mt -69.86 -24.1 63.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.27 -0.894 . . . . 0.0 108.923 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.303 -1.413 0 O-C-N 121.281 -0.887 . . . . 0.0 108.678 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.567 HG21 ' OD1' ' A' ' 97' ' ' ASP . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.438 ' HB3' HG23 ' A' ' 35' ' ' THR . 0.3 OUTLIER -133.63 129.34 36.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.391 -0.818 . . . . 0.0 109.452 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.594 ' HB ' HD13 ' A' ' 100' ' ' LEU . 3.3 tp -107.53 135.26 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.835 . . . . 0.0 109.692 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.538 ' O ' ' N ' ' A' ' 8' ' ' GLU . 83.8 m-20 -98.1 49.12 1.0 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.443 ' CE ' ' O ' ' A' ' 104' ' ' VAL . 0.1 OUTLIER -40.44 -24.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.459 -0.776 . . . . 0.0 109.804 -179.409 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -47.49 -39.31 15.68 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.148 -0.97 . . . . 0.0 109.046 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.75 3.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.329 -0.857 . . . . 0.0 109.399 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -52.34 -69.46 0.11 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.124 -0.985 . . . . 0.0 109.536 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.407 ' C ' ' O ' ' A' ' 10' ' ' CYS . 19.2 ttt180 -44.3 -57.64 3.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.858 -1.151 . . . . 0.0 109.378 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.6 -52.77 53.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -19.17 65.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.408 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.65 ' CE2' ' CE1' ' A' ' 61' ' ' PHE . 0.2 OUTLIER -73.72 -56.3 5.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.373 -0.829 . . . . 0.0 109.721 -179.497 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.734 HD22 HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -77.77 -17.88 57.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.332 -0.855 . . . . 0.0 109.918 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.03 -39.27 86.98 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.125 -0.984 . . . . 0.0 109.356 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.525 HG22 ' O ' ' A' ' 14' ' ' TYR . 16.0 m -70.98 -4.57 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.182 -0.949 . . . . 0.0 109.511 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.24 -0.912 . . . . 0.0 109.404 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.284 0.564 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.551 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -105.67 119.09 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.407 -0.808 . . . . 0.0 109.554 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.814 HG22 ' O ' ' A' ' 42' ' ' GLY . 9.9 tt -48.26 -39.79 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.023 -1.048 . . . . 0.0 108.946 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.698 ' CD1' HG23 ' A' ' 25' ' ' ILE . 34.5 p-90 -156.24 150.68 25.67 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.872 -1.143 . . . . 0.0 110.371 178.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -116.05 152.39 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.445 -0.785 . . . . 0.0 109.479 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.545 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 5.9 p -129.76 135.56 48.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.442 -0.786 . . . . 0.0 110.035 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.435 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -124.15 119.15 28.59 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -100.34 147.79 25.41 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.634 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.781 ' OH ' HG23 ' A' ' 94' ' ' THR . 12.3 m-85 -49.49 98.97 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.552 -0.718 . . . . 0.0 110.113 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.71 101.54 13.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.09 -121.0 23.39 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.22 22.09 16.43 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.392 -1.063 . . . . 0.0 110.081 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.438 HG23 ' HB3' ' A' ' 4' ' ' LYS . 24.0 m -142.72 132.36 23.88 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.28 -0.888 . . . . 0.0 110.042 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.463 ' H ' HD12 ' A' ' 36' ' ' ILE . 4.5 mp -79.12 114.98 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.349 -0.844 . . . . 0.0 108.956 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -135.55 151.88 75.33 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.389 -0.819 . . . . 0.0 109.804 -179.322 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.412 ' C ' ' O ' ' A' ' 37' ' ' VAL . 90.3 Cg_exo -34.57 149.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.653 2.236 . . . . 0.0 111.744 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -136.53 -44.35 0.09 OUTLIER Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.611 ' CG ' HE22 ' A' ' 51' ' ' GLN . 0.7 OUTLIER -143.02 -178.86 6.04 Favored 'General case' 0 C--N 1.294 -1.808 0 O-C-N 121.672 -0.899 . . . . 0.0 109.157 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.613 ' NE2' ' CE1' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -144.85 -166.97 2.54 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.441 -0.787 . . . . 0.0 109.789 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.814 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -166.82 134.45 3.28 Favored Glycine 0 N--CA 1.487 2.051 0 N-CA-C 109.654 -1.379 . . . . 0.0 109.654 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.14 -5.55 19.27 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -158.2 176.11 12.91 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.505 ' CE2' ' CE2' ' A' ' 48' ' ' PHE . 1.6 t80 -73.79 -44.74 55.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.012 -1.055 . . . . 0.0 109.55 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 45' ' ' TYR . 21.7 mm-40 -42.29 -37.89 1.65 Allowed 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.263 -0.898 . . . . 0.0 110.274 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.613 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 3.5 t-160 -60.99 -43.67 98.51 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.061 -1.024 . . . . 0.0 109.781 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.619 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -49.47 -33.99 15.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.133 -0.979 . . . . 0.0 108.707 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.428 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.7 mt -64.36 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.419 -0.8 . . . . 0.0 111.203 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.554 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 2.6 tm0? -85.72 -13.63 47.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.658 -1.276 . . . . 0.0 107.951 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.611 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -96.52 -6.56 36.75 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.583 -178.692 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.57 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 16.8 p -123.37 54.08 1.29 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.416 -0.803 . . . . 0.0 110.317 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.449 ' C ' ' H ' ' A' ' 55' ' ' ASP . 40.9 p -75.48 155.1 36.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.856 -1.152 . . . . 0.0 109.42 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 p30 -71.77 12.58 0.36 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.768 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.449 ' H ' ' C ' ' A' ' 53' ' ' THR . 13.0 t70 -97.67 -0.19 46.01 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.171 -0.955 . . . . 0.0 110.169 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.514 HG13 ' N ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.41 176.07 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 120.909 -1.119 . . . . 0.0 110.634 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.761 ' NE ' HG11 ' A' ' 86' ' ' VAL . 5.5 ptp180 -138.96 134.75 33.56 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.772 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.5 pp -168.6 172.34 8.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.369 -0.832 . . . . 0.0 109.172 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -105.44 152.73 22.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -0.981 . . . . 0.0 109.282 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -130.17 153.56 48.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.418 -0.801 . . . . 0.0 108.998 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.65 ' CE1' ' CE2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -136.78 107.76 6.7 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.395 -0.815 . . . . 0.0 109.038 -179.583 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.416 ' HB ' ' HB3' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -133.1 143.32 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.393 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -83.12 115.89 22.09 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -93.76 155.72 17.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.232 -0.917 . . . . 0.0 110.171 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.57 149.16 34.88 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.505 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 109.547 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HE2' ' HA ' ' A' ' 66' ' ' THR . 8.2 mttm -105.02 150.55 24.86 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.35 -0.844 . . . . 0.0 109.673 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.553 ' O ' ' N ' ' A' ' 109' ' ' ALA . 89.1 m-85 -133.36 117.81 17.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.44 -0.788 . . . . 0.0 109.119 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.71 165.14 28.49 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.973 -1.079 . . . . 0.0 111.456 -178.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 79' ' ' ILE . 11.7 tp -108.89 145.72 34.91 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 114' ' ' ILE . 19.6 mt -131.33 141.44 45.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 120.85 -1.156 . . . . 0.0 108.846 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.0 m -112.62 124.83 53.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.063 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.564 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 60.8 t-105 -96.83 113.34 24.88 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.989 -1.069 . . . . 0.0 109.832 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mm -111.21 93.25 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -74.58 162.79 54.19 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 -179.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -110.46 66.97 0.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.627 -0.926 . . . . 0.0 109.689 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.448 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.2 t0 -169.41 -46.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.218 -0.926 . . . . 0.0 109.552 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.761 HG11 ' NE ' ' A' ' 57' ' ' ARG . 7.4 p -41.62 157.49 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.291 -0.881 . . . . 0.0 109.951 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.459 ' N ' HG22 ' A' ' 86' ' ' VAL . 30.1 p -61.09 173.55 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.414 -0.804 . . . . 0.0 109.971 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.38 -21.49 56.49 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.63 -69.77 0.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.122 -1.222 . . . . 0.0 110.017 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 84.1 mm-40 -49.14 -22.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.81 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 1.7 ttp180 -55.85 -44.13 77.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.808 -1.183 . . . . 0.0 109.436 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.83 -35.66 62.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.234 -0.916 . . . . 0.0 109.894 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.408 ' O ' ' C ' ' A' ' 94' ' ' THR . 10.6 mmmt -74.71 -48.44 25.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -0.919 . . . . 0.0 109.358 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.781 HG23 ' OH ' ' A' ' 31' ' ' TYR . 35.3 m -45.2 -59.5 2.6 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.348 -0.845 . . . . 0.0 109.422 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.73 -59.99 4.03 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 p -63.21 -51.45 66.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.986 -1.302 . . . . 0.0 110.521 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.567 ' OD1' HG21 ' A' ' 3' ' ' THR . 7.4 m-20 -58.45 -45.87 87.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.016 -1.052 . . . . 0.0 110.631 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -51.22 -31.16 19.61 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.847 -1.158 . . . . 0.0 108.24 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.44 -41.18 96.79 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.594 HD13 ' HB ' ' A' ' 5' ' ' ILE . 95.0 mt -48.12 -57.97 5.13 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.536 ' C ' ' H ' ' A' ' 103' ' ' GLU . 4.5 t -56.47 -50.72 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -65.02 7.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.536 ' H ' ' C ' ' A' ' 101' ' ' VAL . 3.0 tt0 -99.77 -44.55 6.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -0.792 . . . . 0.0 109.368 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.781 HG12 ' O ' ' A' ' 104' ' ' VAL . 53.4 t -123.02 62.93 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.439 -0.788 . . . . 0.0 109.863 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.622 HG13 ' O ' ' A' ' 105' ' ' VAL . 4.1 p -132.63 115.22 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.999 -1.063 . . . . 0.0 110.361 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.611 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -125.2 -36.54 2.5 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.181 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.734 HD22 HD22 ' A' ' 15' ' ' ASN . 8.3 m-20 -60.84 32.05 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.928 -0.482 . . . . 0.0 110.245 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.611 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -139.43 139.19 37.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 0.0 109.085 179.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -78.84 -35.58 43.78 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.172 -0.955 . . . . 0.0 109.41 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -162.65 157.72 22.24 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.27 -0.894 . . . . 0.0 109.456 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.73 156.45 17.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 108.922 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -139.14 154.92 48.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.136 -0.978 . . . . 0.0 110.104 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.923 ' O ' HD13 ' A' ' 114' ' ' ILE . 6.7 p -119.5 157.76 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.923 HD13 ' O ' ' A' ' 113' ' ' VAL . 2.4 mm -136.33 148.23 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.183 -0.948 . . . . 0.0 109.826 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.53 -3.92 2.97 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.434 ' O ' ' N ' ' A' ' 119' ' ' GLU . 0.1 OUTLIER -157.76 133.61 9.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.298 -0.876 . . . . 0.0 109.51 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.415 ' C ' ' O ' ' A' ' 116' ' ' ASP . 25.4 ttp180 -44.25 -25.37 0.23 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.254 -0.903 . . . . 0.0 109.625 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 116' ' ' ASP . 16.3 tttt -75.82 -18.56 59.43 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.174 -0.954 . . . . 0.0 109.359 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 59.4 mt-10 -86.28 -3.38 58.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.335 -0.853 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.613 HD13 ' CE1' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -105.27 31.41 4.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.176 -0.953 . . . . 0.0 108.866 -179.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -83.04 155.1 24.09 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.509 -0.744 . . . . 0.0 109.783 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.15 -50.77 60.05 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.112 -0.993 . . . . 0.0 109.44 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.3 -15.3 9.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.891 . . . . 0.0 109.936 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.608 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 15.0 t80 -84.8 -49.28 8.57 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 0.0 109.184 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.542 ' CG2' HD12 ' A' ' 129' ' ' LEU . 3.0 mt -77.99 -11.88 13.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.802 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.14 -55.86 5.07 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.346 -0.846 . . . . 0.0 108.87 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -17.54 64.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.264 -0.897 . . . . 0.0 109.461 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.439 ' CA ' ' OE1' ' A' ' 128' ' ' GLU . 0.1 OUTLIER -84.74 -40.14 17.64 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.336 -0.852 . . . . 0.0 109.364 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.542 HD12 ' CG2' ' A' ' 125' ' ' ILE . 2.5 mt -79.24 -7.97 58.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.29 -0.881 . . . . 0.0 109.724 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.512 0 O-C-N 121.05 -1.031 . . . . 0.0 108.942 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.3 0.571 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB3' HG23 ' A' ' 35' ' ' THR . 4.7 mmtp -136.73 118.61 15.19 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.0 109.427 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.763 ' CD1' HG22 ' A' ' 101' ' ' VAL . 0.9 OUTLIER -107.07 142.29 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.304 -0.873 . . . . 0.0 109.895 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.442 ' O ' ' C ' ' A' ' 7' ' ' LYS . 9.7 m-20 -90.25 44.5 1.2 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.301 -0.874 . . . . 0.0 108.974 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -38.68 -31.13 0.05 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.613 -0.679 . . . . 0.0 110.336 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' A' ' 6' ' ' ASP . 31.4 mt-10 -55.06 -51.22 67.03 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.22 -0.925 . . . . 0.0 110.307 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.96 -69.38 0.18 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.131 -0.981 . . . . 0.0 110.368 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -44.74 -57.89 3.42 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.218 -0.926 . . . . 0.0 110.465 -179.168 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.577 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 19.3 ttt180 -44.99 -58.54 3.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.93 -1.106 . . . . 0.0 110.266 -178.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.06 -46.42 82.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.218 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.402 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -77.39 -10.54 59.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.046 -1.034 . . . . 0.0 110.348 -179.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.5 m-85 -81.31 -54.2 5.68 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.762 HD22 HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -75.99 -14.41 60.23 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.188 -0.945 . . . . 0.0 109.461 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' A' ' 18' ' ' ARG . 5.2 tt -73.48 -51.48 16.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.379 -0.825 . . . . 0.0 109.474 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 17' ' ' VAL . 3.3 p -55.37 -4.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.206 -0.934 . . . . 0.0 109.524 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.303 -1.418 0 O-C-N 121.303 -0.873 . . . . 0.0 109.453 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.34 0.591 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.796 ' O ' HG12 ' A' ' 24' ' ' VAL . 75.7 t 47.24 52.28 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.162 -0.961 . . . . 0.0 109.365 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.906 HG23 ' CD1' ' A' ' 26' ' ' TRP . 12.8 tt -46.26 -29.78 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 120.824 -1.172 . . . . 0.0 108.575 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.906 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.2 p-90 -156.17 150.94 26.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.879 -1.138 . . . . 0.0 110.076 177.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -113.24 144.84 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.535 -0.728 . . . . 0.0 109.797 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 59' ' ' PHE . 18.4 p -138.11 132.73 32.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.42 -0.8 . . . . 0.0 109.77 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.24 145.15 47.31 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.46 ' O ' ' N ' ' A' ' 32' ' ' ASP . 24.7 ptt180 -119.49 141.29 49.31 Favored 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 119.765 -0.774 . . . . 0.0 109.95 -178.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.45 ' CD1' ' NE2' ' A' ' 90' ' ' GLN . 0.6 OUTLIER -41.28 98.44 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.718 -0.614 . . . . 0.0 109.783 -179.422 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -91.47 101.99 14.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 54.11 -116.51 6.31 Favored Glycine 0 N--CA 1.487 2.087 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.52 25.3 11.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.391 -1.064 . . . . 0.0 110.211 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.409 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.7 m -146.31 133.91 20.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.193 -0.942 . . . . 0.0 109.816 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.1 mp -81.72 111.98 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.031 -1.043 . . . . 0.0 108.73 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.45 152.49 76.6 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.347 -0.846 . . . . 0.0 109.977 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -39.16 140.44 0.48 Allowed 'Trans proline' 0 C--N 1.311 -1.409 0 C-N-CA 122.659 2.239 . . . . 0.0 112.249 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.18 -33.49 0.36 Allowed Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.535 ' CB ' HE22 ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.12 -177.93 5.59 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.619 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.3 OUTLIER -138.44 -176.94 4.64 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-O 121.821 0.82 . . . . 0.0 110.387 -179.826 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.633 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -119.66 83.71 0.36 Allowed Glycine 0 N--CA 1.479 1.556 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.607 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -104.71 56.38 0.7 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.643 -0.916 . . . . 0.0 108.53 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.607 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 33.5 t0 120.21 140.84 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -179.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -56.86 -47.36 80.6 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.067 -1.021 . . . . 0.0 108.462 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -53.27 -34.87 59.05 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.345 -0.847 . . . . 0.0 109.416 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.469 ' ND1' ' NE2' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -53.21 -28.95 29.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.0 108.896 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.24 -34.98 75.66 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.43 HG12 ' CE2' ' A' ' 48' ' ' PHE . 4.5 mt -76.29 -13.97 14.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.222 -0.924 . . . . 0.0 109.553 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.525 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 26.4 tp60 -87.67 -50.41 6.51 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.105 -0.997 . . . . 0.0 109.411 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.535 HE22 ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -108.07 55.97 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.64 -0.662 . . . . 0.0 111.145 -178.183 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.1 t -162.32 62.66 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.082 -1.011 . . . . 0.0 109.184 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.583 ' O ' ' N ' ' A' ' 55' ' ' ASP . 2.5 p -87.54 154.68 20.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.404 -0.81 . . . . 0.0 109.916 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -46.14 -11.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.856 . . . . 0.0 109.652 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 53' ' ' THR . 1.9 t70 -93.27 35.37 1.09 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.202 -0.936 . . . . 0.0 109.403 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.581 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 53.3 t -145.4 145.3 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.282 -0.886 . . . . 0.0 109.45 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.654 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.51 122.98 27.08 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.48 -0.762 . . . . 0.0 109.68 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.606 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.84 -170.93 0.71 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.934 -1.104 . . . . 0.0 110.718 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.623 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -118.32 153.61 33.69 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.213 -0.929 . . . . 0.0 109.145 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -136.31 156.35 48.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.791 -1.193 . . . . 0.0 109.309 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -149.56 103.35 3.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.16 -0.962 . . . . 0.0 109.375 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -118.37 154.37 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.241 -0.912 . . . . 0.0 109.602 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.582 ' NH2' ' O ' ' A' ' 17' ' ' VAL . 14.4 ttp180 -84.61 130.73 34.69 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -118.26 157.1 27.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.439 -0.788 . . . . 0.0 109.83 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.58 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . 8.7 t -97.0 140.96 30.75 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.314 -0.866 . . . . 0.0 109.044 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.4 -0.813 . . . . 0.0 109.614 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.0 p . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.58 ' NZ ' ' O ' ' A' ' 65' ' ' THR . 4.2 pttm -107.32 130.93 54.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.364 -0.835 . . . . 0.0 109.215 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.518 ' O ' ' N ' ' A' ' 109' ' ' ALA . 98.9 m-85 -103.82 129.3 51.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 110.275 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.57 161.95 37.82 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.126 -0.984 . . . . 0.0 111.241 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.8 157.44 25.56 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.9 mt -137.55 143.38 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 120.843 -1.161 . . . . 0.0 109.309 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.596 ' N ' ' O ' ' A' ' 112' ' ' PHE . 0.2 OUTLIER -100.82 114.83 28.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.162 -0.961 . . . . 0.0 109.03 179.636 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.597 ' CH2' ' O ' ' A' ' 115' ' ' SER . 73.5 t-105 -92.81 110.49 21.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.142 -0.973 . . . . 0.0 109.785 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.463 ' O ' ' OG ' ' A' ' 115' ' ' SER . 8.1 mm -114.88 92.5 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.03 161.09 0.05 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -88.36 -20.27 25.55 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -1.109 . . . . 0.0 109.457 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.49 41.46 1.23 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 109.505 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.514 HG12 ' N ' ' A' ' 87' ' ' SER . 52.0 t -96.83 161.98 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.228 -0.92 . . . . 0.0 109.732 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.514 ' N ' HG12 ' A' ' 86' ' ' VAL . 7.9 t -95.32 -162.47 0.95 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.253 -0.904 . . . . 0.0 109.42 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.06 -18.12 63.69 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.5 mt -46.69 -60.86 2.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.912 -1.346 . . . . 0.0 109.79 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.45 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 22.3 mm-40 -56.8 -30.76 64.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.006 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -50.93 -62.32 1.68 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.924 -1.11 . . . . 0.0 109.916 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.99 -44.04 15.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.161 -0.962 . . . . 0.0 110.014 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.401 ' O ' ' OH ' ' A' ' 31' ' ' TYR . 21.3 mtpt -58.43 -58.93 6.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.207 -0.933 . . . . 0.0 110.007 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.442 ' OG1' ' CD ' ' A' ' 90' ' ' GLN . 2.1 m -57.19 -40.82 78.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.111 -0.993 . . . . 0.0 109.487 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -43.72 -59.61 3.67 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.164 -1.175 . . . . 0.0 110.164 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.9 p -63.8 -42.88 97.63 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.072 -1.252 . . . . 0.0 110.845 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.0 -44.18 90.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.852 -1.155 . . . . 0.0 111.192 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -26.56 45.88 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.683 -1.261 . . . . 0.0 108.899 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -50.78 48.67 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.431 -0.793 . . . . 0.0 109.275 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.577 ' N ' HD12 ' A' ' 100' ' ' LEU . 8.5 mp -57.3 -59.49 5.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.763 HG22 ' CD1' ' A' ' 5' ' ' ILE . 21.8 t -44.46 -69.18 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.847 . . . . 0.0 109.409 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 ttpp -48.61 -47.79 39.74 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.466 -0.771 . . . . 0.0 110.046 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.86 -31.55 71.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 111.013 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.7 p -106.28 13.71 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.096 -1.003 . . . . 0.0 110.747 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.493 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -108.39 124.43 64.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.102 -0.999 . . . . 0.0 109.829 179.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.648 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -126.51 -30.21 2.86 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 179.572 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.762 HD22 HD22 ' A' ' 15' ' ' ASN . 2.2 t-20 -62.39 29.27 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.537 -0.727 . . . . 0.0 109.93 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.648 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -141.95 160.85 39.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.153 -0.967 . . . . 0.0 109.238 179.502 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -95.66 -37.97 10.58 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.824 . . . . 0.0 109.609 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -158.29 159.83 36.38 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 109.438 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.75 160.48 14.94 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 109.172 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.596 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.9 m-85 -138.54 149.71 45.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.286 -0.884 . . . . 0.0 109.875 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.403 ' HA ' ' HG1' ' A' ' 80' ' ' THR . 58.6 t -114.67 118.73 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.525 -0.734 . . . . 0.0 109.036 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.497 HG23 ' OE2' ' A' ' 119' ' ' GLU . 7.2 mt -138.55 158.62 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.0 110.289 -179.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.597 ' O ' ' CH2' ' A' ' 81' ' ' TRP . 11.2 t -134.1 -46.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.95 155.57 23.95 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.59 -0.694 . . . . 0.0 109.619 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -79.62 -17.82 52.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.107 -0.995 . . . . 0.0 109.841 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 60.4 tttt -73.51 -33.47 64.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.003 . . . . 0.0 109.832 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.588 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 0.3 OUTLIER -86.34 5.02 36.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.062 -1.024 . . . . 0.0 109.853 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.471 HD22 ' CE1' ' A' ' 48' ' ' PHE . 4.0 tt -104.26 0.45 29.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.166 -0.959 . . . . 0.0 109.188 179.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -49.5 139.36 12.22 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.428 -0.795 . . . . 0.0 109.798 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.542 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.1 OUTLIER -52.08 -53.81 37.89 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 109.878 -179.871 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . 0.401 ' OD1' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.01 -48.81 72.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.096 -1.002 . . . . 0.0 109.825 -179.265 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 65.9 t80 -48.48 -42.69 33.53 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 122.203 1.001 . . . . 0.0 109.073 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -76.11 -24.28 16.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.908 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.7 ttp180 -65.1 -55.71 17.18 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.238 -0.914 . . . . 0.0 109.107 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.0 t -62.52 -21.4 65.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -76.55 -41.74 45.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.436 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.3 mt -69.14 -38.7 78.96 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.154 -0.966 . . . . 0.0 108.56 179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? . . . . . 0 C--N 1.305 -1.362 0 O-C-N 121.153 -0.967 . . . . 0.0 108.567 178.891 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.451 ' CB ' HG23 ' A' ' 35' ' ' THR . 3.7 mtpt -130.18 135.95 48.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.394 -0.816 . . . . 0.0 109.48 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.522 ' HB ' HD13 ' A' ' 100' ' ' LEU . 3.9 tp -118.46 130.28 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.47 -0.769 . . . . 0.0 109.335 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.504 ' O ' ' N ' ' A' ' 8' ' ' GLU . 5.6 m-20 -91.73 39.68 1.02 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.118 -0.989 . . . . 0.0 109.051 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.694 ' NZ ' ' H ' ' A' ' 104' ' ' VAL . 3.5 mttt -42.43 -23.34 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.813 -179.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.52 ' H ' ' CD ' ' A' ' 8' ' ' GLU . 39.3 mp0 -50.11 -35.46 25.69 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.093 -1.005 . . . . 0.0 108.364 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.42 -46.02 13.01 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.57 ' O ' ' N ' ' A' ' 14' ' ' TYR . 13.0 t -60.67 -66.17 0.57 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.242 -0.911 . . . . 0.0 109.489 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.484 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 32.0 ttp180 -44.19 -56.24 4.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.756 -1.215 . . . . 0.0 109.882 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.13 -28.07 67.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.01 -1.056 . . . . 0.0 109.762 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.458 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -88.5 -58.22 2.63 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.073 -1.017 . . . . 0.0 109.605 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.661 ' CD1' ' CD1' ' A' ' 61' ' ' PHE . 5.9 t80 -45.16 -51.18 10.76 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.301 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.536 ' N ' ' ND2' ' A' ' 15' ' ' ASN . 0.3 OUTLIER -71.22 -45.04 64.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.023 -1.048 . . . . 0.0 110.248 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.522 ' C ' ' H ' ' A' ' 18' ' ' ARG . 20.6 tp -41.54 -48.64 3.98 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.076 -1.015 . . . . 0.0 110.063 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 14' ' ' TYR . 1.2 m -53.85 -4.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.062 -1.024 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.522 ' H ' ' C ' ' A' ' 16' ' ' LEU . 6.8 ttm180 . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.149 -0.97 . . . . 0.0 109.285 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.469 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.721 HG22 ' O ' ' A' ' 24' ' ' VAL . 4.6 p 35.39 57.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.676 -0.64 . . . . 0.0 110.458 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.813 HG22 ' O ' ' A' ' 42' ' ' GLY . 6.9 tt -42.92 -41.63 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.173 -0.954 . . . . 0.0 109.267 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.663 ' CD1' HG23 ' A' ' 25' ' ' ILE . 43.2 p-90 -149.25 166.78 27.89 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 120.992 -1.067 . . . . 0.0 110.261 178.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.453 HG13 ' CG2' ' A' ' 24' ' ' VAL . 18.3 m -137.68 141.81 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.891 . . . . 0.0 109.329 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.596 HG23 ' CE3' ' A' ' 26' ' ' TRP . 66.5 p -129.17 140.19 51.61 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 109.877 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.99 125.27 44.93 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -100.08 148.39 24.61 Favored 'General case' 0 C--N 1.296 -1.722 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.334 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.925 ' OH ' HG23 ' A' ' 94' ' ' THR . 23.0 m-85 -57.87 98.7 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.558 -0.714 . . . . 0.0 109.779 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.61 102.07 13.47 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.28 -126.14 9.18 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.95 17.9 21.26 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.41 -1.053 . . . . 0.0 110.041 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.451 HG23 ' CB ' ' A' ' 4' ' ' LYS . 1.8 m -138.23 136.4 36.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.244 -0.91 . . . . 0.0 110.042 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.521 ' CD1' ' OD1' ' A' ' 97' ' ' ASP . 4.3 mp -79.78 115.36 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.38 150.83 73.56 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 109.937 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -34.56 152.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.376 0 C-N-CA 122.89 2.393 . . . . 0.0 112.324 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.29 -53.25 0.07 OUTLIER Glycine 0 N--CA 1.489 2.207 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.582 ' OD1' ' N ' ' A' ' 41' ' ' GLN . 14.1 t70 -143.28 179.53 7.03 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.713 -0.875 . . . . 0.0 108.976 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.589 ' CD ' ' H ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -140.98 -165.98 2.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 110.057 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.813 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.06 131.65 2.5 Favored Glycine 0 N--CA 1.486 1.969 0 N-CA-C 109.864 -1.295 . . . . 0.0 109.864 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.83 -5.06 21.51 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -148.3 164.84 32.81 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.56 ' C ' ' CD1' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -78.48 -11.4 59.95 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.033 -1.042 . . . . 0.0 109.585 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.54 -31.23 63.55 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.057 -1.027 . . . . 0.0 109.759 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.448 ' O ' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.47 -51.84 32.3 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.978 -1.076 . . . . 0.0 109.751 -179.666 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.687 ' CE1' HD22 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -43.25 -36.75 1.9 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.548 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.425 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mm -63.65 -41.31 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.339 -0.85 . . . . 0.0 110.455 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.543 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 1.6 tm0? -87.06 -15.74 37.67 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.489 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER -99.25 61.47 1.22 Allowed 'General case' 0 C--N 1.3 -1.579 0 CA-C-O 122.261 1.029 . . . . 0.0 109.925 -179.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 14.3 p -179.86 56.63 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.27 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.555 ' O ' ' NE1' ' A' ' 81' ' ' TRP . 3.1 p -77.87 156.01 30.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.058 -1.026 . . . . 0.0 110.025 -179.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.13 12.35 0.57 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.815 . . . . 0.0 109.847 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 53' ' ' THR . 20.9 m-20 -97.89 1.21 47.85 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.199 -0.938 . . . . 0.0 109.74 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.567 HG13 ' N ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.34 -179.65 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.043 -1.036 . . . . 0.0 110.293 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.802 ' CZ ' HG11 ' A' ' 86' ' ' VAL . 5.2 ptp180 -140.17 138.64 35.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.32 -0.862 . . . . 0.0 110.024 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.746 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.7 pp -172.22 169.09 5.54 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.418 -0.802 . . . . 0.0 109.409 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.529 ' O ' HG22 ' A' ' 28' ' ' THR . 3.8 m-85 -101.02 153.02 19.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.028 -1.045 . . . . 0.0 109.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.737 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -123.94 152.31 42.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.302 -0.874 . . . . 0.0 109.045 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.661 ' CD1' ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -140.47 96.34 3.02 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.413 -0.805 . . . . 0.0 109.087 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.5 ' O ' ' CE2' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -133.99 129.87 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 120.735 -1.228 . . . . 0.0 109.869 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.653 ' HE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ptm180 -68.16 142.86 55.6 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.175 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.5 ' CE2' ' O ' ' A' ' 62' ' ' VAL . 97.9 m-85 -118.79 155.92 30.3 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.796 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 m -81.75 131.43 35.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.157 -0.965 . . . . 0.0 109.037 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.353 -0.842 . . . . 0.0 109.484 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.653 ' CB ' ' HE ' ' A' ' 63' ' ' ARG . 21.0 p . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.189 0.519 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.688 ' NZ ' ' HB3' ' A' ' 109' ' ' ALA . 3.7 ttpt -104.59 170.2 8.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.443 -0.786 . . . . 0.0 109.08 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 109' ' ' ALA . 79.1 m-85 -134.06 126.78 30.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.126 -0.984 . . . . 0.0 111.289 -178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.508 ' HB2' ' NZ ' ' A' ' 75' ' ' LYS . . . -144.79 166.6 24.79 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.518 -0.739 . . . . 0.0 110.439 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.549 HD12 ' CE2' ' A' ' 61' ' ' PHE . 2.1 tt -113.85 151.43 32.14 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.737 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 7.6 mt -128.22 131.93 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 120.949 -1.094 . . . . 0.0 109.563 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.5 m -100.98 124.61 46.96 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.348 -0.845 . . . . 0.0 109.831 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.555 ' NE1' ' O ' ' A' ' 53' ' ' THR . 58.0 t-105 -102.45 111.96 24.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.175 -0.953 . . . . 0.0 109.831 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mm -109.86 93.35 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.26 153.95 48.03 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -104.63 56.26 0.71 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.63 -0.923 . . . . 0.0 109.612 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 86' ' ' VAL . 7.9 t70 -158.59 -39.02 0.06 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.217 -0.927 . . . . 0.0 109.528 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.802 HG11 ' CZ ' ' A' ' 57' ' ' ARG . 12.6 p -40.87 156.97 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.981 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.414 ' N ' HG22 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -66.95 -176.1 0.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.312 -0.868 . . . . 0.0 109.54 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.459 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.35 -22.76 53.46 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -46.68 -70.03 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.153 -1.204 . . . . 0.0 110.074 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.433 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 17.3 mt-30 -48.06 -21.71 0.5 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 109.82 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.459 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 5.7 ttt180 -58.66 -45.26 89.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.966 -1.084 . . . . 0.0 109.578 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.48 -37.4 56.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.247 -0.908 . . . . 0.0 109.793 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 94' ' ' THR . 4.4 mttm -73.71 -52.94 11.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.154 -0.966 . . . . 0.0 109.539 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.925 HG23 ' OH ' ' A' ' 31' ' ' TYR . 59.6 m -45.34 -56.02 5.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -44.38 -60.2 3.76 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -63.79 -50.73 67.83 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.974 -1.309 . . . . 0.0 110.223 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.521 ' OD1' ' CD1' ' A' ' 36' ' ' ILE . 3.4 t70 -57.14 -47.05 82.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.989 -1.069 . . . . 0.0 110.283 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 97' ' ' ASP . 6.1 ptmt -47.62 -33.32 6.52 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.839 -1.145 . . . . 0.0 107.984 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.7 m -59.87 -40.33 88.29 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.522 HD13 ' HB ' ' A' ' 5' ' ' ILE . 95.6 mt -49.75 -60.4 2.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.537 ' C ' ' H ' ' A' ' 103' ' ' GLU . 21.6 t -53.36 -46.62 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -65.44 7.85 0.19 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.537 ' H ' ' C ' ' A' ' 101' ' ' VAL . 19.8 tt0 -100.05 -44.58 5.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.427 -0.796 . . . . 0.0 110.325 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.784 HG12 ' O ' ' A' ' 104' ' ' VAL . 77.2 t -126.01 60.05 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.233 -0.917 . . . . 0.0 110.839 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.578 HG12 ' O ' ' A' ' 105' ' ' VAL . 4.2 t -130.52 96.94 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.075 -1.016 . . . . 0.0 109.56 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.585 ' C ' ' H ' ' A' ' 108' ' ' PHE . 35.0 mt-30 -120.2 -35.67 3.4 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.444 ' CG ' ' O ' ' A' ' 107' ' ' ASN . 36.6 t30 -62.53 35.45 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.7 -0.625 . . . . 0.0 110.298 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.585 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -139.14 150.69 45.93 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.164 -0.96 . . . . 0.0 108.983 178.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.688 ' HB3' ' NZ ' ' A' ' 75' ' ' LYS . . . -79.48 -44.27 21.6 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.331 -0.856 . . . . 0.0 109.502 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -160.87 159.51 29.87 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.143 -0.973 . . . . 0.0 109.481 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.62 157.41 17.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.25 -0.906 . . . . 0.0 109.164 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -117.75 142.35 47.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.643 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.8 t -110.6 97.03 5.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.448 HG22 ' H ' ' A' ' 116' ' ' ASP . 10.3 mm -103.47 152.32 6.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 O-C-N 121.3 -0.875 . . . . 0.0 110.828 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.5 p -139.77 5.37 2.17 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.448 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -160.46 155.39 24.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.386 -0.821 . . . . 0.0 109.271 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 20.7 mtm180 -67.08 -24.12 65.93 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 0.0 109.769 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -69.33 -23.03 63.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.0 109.216 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.421 ' CB ' HG23 ' A' ' 114' ' ' ILE . 30.0 mt-10 -86.56 -1.89 58.02 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.389 -0.819 . . . . 0.0 109.648 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.687 HD22 ' CE1' ' A' ' 48' ' ' PHE . 2.9 mt -107.08 25.54 11.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.257 -0.902 . . . . 0.0 109.429 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -82.98 146.32 28.85 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.403 -0.811 . . . . 0.0 109.646 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 1.001 ' HB2' ' NH2' ' A' ' 126' ' ' ARG . 0.2 OUTLIER -52.56 -55.32 23.04 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.132 -0.98 . . . . 0.0 109.338 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.11 -19.66 14.14 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.306 -0.872 . . . . 0.0 110.232 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.501 ' C ' ' CD1' ' A' ' 124' ' ' PHE . 16.5 t80 -86.86 -49.14 7.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.215 -0.928 . . . . 0.0 109.074 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.3 mm -75.96 -25.7 17.2 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.788 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 1.001 ' NH2' ' HB2' ' A' ' 122' ' ' GLU . 1.8 ttm-85 -73.04 -54.64 8.05 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.159 -0.963 . . . . 0.0 109.007 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.8 t -63.81 -12.39 35.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.412 -0.805 . . . . 0.0 109.578 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -84.82 -38.11 19.93 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.19 -0.944 . . . . 0.0 109.601 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.615 HD22 ' NZ ' ' A' ' 75' ' ' LYS . 92.2 mt -72.57 -39.99 66.98 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.946 . . . . 0.0 109.315 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . 0.991 ' HA ' ' HZ2' ' A' ' 130' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.094 -1.004 . . . . 0.0 109.512 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . 0.617 HG21 ' OD1' ' A' ' 97' ' ' ASP . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -134.06 118.27 17.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.385 -0.822 . . . . 0.0 109.176 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.89 140.41 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.869 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 2.6 t70 -97.07 45.48 1.04 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 108.959 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.446 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -40.46 -21.58 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.432 -0.793 . . . . 0.0 109.724 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.7 tt0 -52.88 -42.17 65.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.241 -0.912 . . . . 0.0 109.28 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.57 -67.04 0.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.192 -0.942 . . . . 0.0 109.419 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.646 ' SG ' ' CE2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -44.69 -60.59 1.93 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.206 -0.934 . . . . 0.0 109.701 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.568 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 11.3 ttp180 -44.22 -58.54 2.82 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.927 -1.108 . . . . 0.0 109.778 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.68 -28.94 16.27 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.062 -1.024 . . . . 0.0 109.229 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.946 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -87.69 -50.92 6.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.198 -0.938 . . . . 0.0 109.776 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.481 ' OH ' HD12 ' A' ' 78' ' ' LEU . 6.1 m-85 -45.74 -56.17 5.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.941 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.779 ' H ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -64.25 -40.1 95.31 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.11 -0.994 . . . . 0.0 109.411 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.6 -25.5 66.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.884 . . . . 0.0 109.275 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.946 HG23 ' O ' ' A' ' 13' ' ' ALA . 29.6 t -80.88 -13.9 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.245 -0.909 . . . . 0.0 109.377 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.241 179.878 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 25' ' ' ILE . . . . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.21 0.528 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.793 HG23 ' O ' ' A' ' 24' ' ' VAL . 12.4 m -59.35 70.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.31 -0.869 . . . . 0.0 110.449 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.806 HG23 ' CD1' ' A' ' 26' ' ' TRP . 2.2 tt -45.69 -41.73 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.923 -1.11 . . . . 0.0 108.366 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.806 ' CD1' HG23 ' A' ' 25' ' ' ILE . 33.2 p-90 -142.95 136.97 29.07 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.714 -1.241 . . . . 0.0 109.776 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -115.24 144.87 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.42 -0.8 . . . . 0.0 110.107 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.598 ' HB ' HD13 ' A' ' 58' ' ' LEU . 6.4 p -133.71 144.02 48.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.429 -0.795 . . . . 0.0 110.972 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.646 ' CE2' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -129.42 130.05 45.47 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 179.297 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -107.7 149.43 28.15 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.465 -0.772 . . . . 0.0 109.597 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.405 ' OH ' HG23 ' A' ' 94' ' ' THR . 6.0 m-85 -49.02 98.73 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.455 -0.778 . . . . 0.0 109.912 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.64 101.61 13.48 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.94 -119.07 16.59 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.08 22.83 15.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.394 -1.062 . . . . 0.0 110.015 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 m -145.7 129.35 17.1 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.19 -0.944 . . . . 0.0 109.765 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.747 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.6 mp -78.54 113.84 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 108.947 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.424 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -135.58 153.7 77.77 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.285 -0.884 . . . . 0.0 109.822 -179.304 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.424 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.9 Cg_exo -32.02 145.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.357 0 C-N-CA 122.989 2.46 . . . . 0.0 112.26 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -139.1 -33.38 0.17 Allowed Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.542 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -143.28 -179.0 6.13 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 121.715 -0.873 . . . . 0.0 109.276 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.779 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -153.17 -171.53 3.95 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.797 0.808 . . . . 0.0 110.838 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.68 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -166.71 128.2 1.71 Allowed Glycine 0 N--CA 1.483 1.822 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.08 -10.04 17.43 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -155.35 172.05 18.85 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.467 ' OH ' ' O ' ' A' ' 120' ' ' LEU . 9.4 t80 -70.22 -45.83 65.75 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 120.895 -1.128 . . . . 0.0 109.332 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.458 ' N ' ' CD ' ' A' ' 46' ' ' GLN . 1.2 mp0 -46.94 -39.19 11.84 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.083 -1.011 . . . . 0.0 110.087 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.664 ' CE1' HE22 ' A' ' 41' ' ' GLN . 0.4 OUTLIER -53.18 -24.65 11.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.696 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.576 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -72.3 -25.77 61.71 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.175 -0.953 . . . . 0.0 109.074 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.447 HG12 ' CE2' ' A' ' 48' ' ' PHE . 7.4 mt -83.35 -15.81 11.41 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 O-C-N 121.104 -0.998 . . . . 0.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.514 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 13.6 tp60 -88.3 -53.18 4.82 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.986 -1.071 . . . . 0.0 110.665 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.614 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -102.79 55.87 0.77 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.509 -0.745 . . . . 0.0 111.681 -177.427 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.576 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 34.4 m -155.38 63.64 0.62 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.93 -1.106 . . . . 0.0 109.792 179.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.596 ' C ' ' H ' ' A' ' 55' ' ' ASP . 10.2 p -87.75 158.67 18.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.146 -0.971 . . . . 0.0 110.029 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -60.23 12.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.333 -0.854 . . . . 0.0 110.56 -179.69 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.596 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -111.23 27.79 9.35 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 109.878 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.536 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.0 OUTLIER -148.21 148.76 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.087 -1.008 . . . . 0.0 109.816 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.561 ' CD ' ' H ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -125.99 128.75 47.96 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.459 -0.776 . . . . 0.0 109.625 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.598 HD13 ' HB ' ' A' ' 28' ' ' THR . 2.7 pp -172.64 -173.38 1.0 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.046 -1.034 . . . . 0.0 109.985 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.564 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 3.4 m-85 -114.68 159.18 20.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.354 -0.842 . . . . 0.0 108.812 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 79' ' ' ILE . . . -139.34 150.99 46.01 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.789 -1.194 . . . . 0.0 109.143 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.516 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 28.1 t80 -148.86 97.11 2.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.175 -0.953 . . . . 0.0 109.181 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -117.07 152.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.071 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.9 119.07 22.26 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.491 -0.756 . . . . 0.0 109.163 179.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -100.47 156.22 17.39 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 0.0 109.573 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.0 t -77.73 141.64 39.19 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.17 -0.956 . . . . 0.0 108.975 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.472 -0.767 . . . . 0.0 109.42 -179.905 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.8 mmtt -104.63 158.09 16.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 109.813 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.49 ' O ' ' N ' ' A' ' 109' ' ' ALA . 65.7 m-85 -133.5 118.99 18.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.486 -0.759 . . . . 0.0 109.459 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.28 160.33 41.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.407 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.481 HD12 ' OH ' ' A' ' 14' ' ' TYR . 5.3 tt -105.99 157.13 17.73 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.593 HG21 HD11 ' A' ' 120' ' ' LEU . 2.8 mt -135.13 136.1 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.072 -1.017 . . . . 0.0 108.961 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -95.96 117.16 30.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.584 ' N ' ' O ' ' A' ' 58' ' ' LEU . 66.8 t-105 -95.22 111.25 23.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.869 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.415 ' O ' ' C ' ' A' ' 83' ' ' GLY . 4.4 mm -116.41 92.77 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.66 161.77 0.06 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -88.85 -27.49 21.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.344 -1.092 . . . . 0.0 109.565 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.9 47.59 0.87 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.323 -0.86 . . . . 0.0 109.664 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.23 166.26 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.286 -0.884 . . . . 0.0 109.733 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.533 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 11.2 t -87.11 -170.92 3.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.398 -0.814 . . . . 0.0 109.748 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.533 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.2 -16.64 66.56 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -45.93 -41.37 11.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.134 -1.215 . . . . 0.0 109.822 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.651 ' H ' ' CD ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -68.76 -29.38 67.76 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.113 -0.992 . . . . 0.0 109.076 179.641 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.439 ' N ' ' O ' ' A' ' 88' ' ' GLY . 10.0 tmm_? -53.59 -60.78 2.87 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 110.206 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.62 -42.63 34.27 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.11 -0.994 . . . . 0.0 110.131 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -61.96 -63.65 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.102 -0.999 . . . . 0.0 110.049 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.405 HG23 ' OH ' ' A' ' 31' ' ' TYR . 13.6 m -45.33 -51.56 10.92 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.152 -0.967 . . . . 0.0 109.806 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -43.19 -65.46 1.45 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -49.48 72.93 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.106 -1.232 . . . . 0.0 111.34 -178.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.617 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.1 OUTLIER -68.23 -39.75 82.22 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.87 -1.144 . . . . 0.0 111.593 -177.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -23.95 64.67 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 120.732 -1.23 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.0 m -83.32 -20.52 34.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 108.694 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -79.56 -61.22 2.07 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.433 -0.792 . . . . 0.0 109.366 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.1 p -56.46 -28.37 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.244 -0.91 . . . . 0.0 109.971 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.864 ' O ' HG12 ' A' ' 105' ' ' VAL . 16.4 tttt -71.55 -39.56 70.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.127 -0.983 . . . . 0.0 109.708 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.62 -31.4 69.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.111 -0.993 . . . . 0.0 110.097 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.6 t -97.14 36.92 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 102' ' ' LYS . 8.4 p -119.53 66.02 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.272 -0.892 . . . . 0.0 109.404 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.15 42.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.204 -0.935 . . . . 0.0 109.802 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.759 ' ND2' HD22 ' A' ' 15' ' ' ASN . 4.3 m-20 -136.33 -31.04 0.9 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.553 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -72.78 -164.65 0.17 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.323 -0.861 . . . . 0.0 110.104 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -132.6 -27.58 1.71 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.504 -0.747 . . . . 0.0 109.091 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 21.3 tttp -162.2 150.63 14.87 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.304 -0.873 . . . . 0.0 109.404 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.81 149.23 25.83 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.241 -0.912 . . . . 0.0 109.278 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -135.74 153.98 51.39 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.343 -0.848 . . . . 0.0 109.966 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 5.8 p -120.9 137.7 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.65 HG22 ' H ' ' A' ' 116' ' ' ASP . 4.4 mm -127.07 160.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.858 . . . . 0.0 110.433 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.518 ' N ' HG22 ' A' ' 114' ' ' ILE . 14.3 t -140.63 5.64 2.01 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.65 ' H ' HG22 ' A' ' 114' ' ' ILE . 49.6 m-20 -146.06 155.3 42.69 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.37 -0.831 . . . . 0.0 109.392 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -75.99 -30.93 58.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.241 -0.912 . . . . 0.0 110.045 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -76.17 -7.73 55.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.145 -0.972 . . . . 0.0 109.368 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.907 ' OE1' ' CE1' ' A' ' 124' ' ' PHE . 2.4 mm-40 -86.58 3.87 42.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.205 -0.934 . . . . 0.0 109.785 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.593 HD11 HG21 ' A' ' 79' ' ' ILE . 1.6 tp -98.91 -0.35 42.46 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.236 -0.915 . . . . 0.0 108.993 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.19 144.41 12.55 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.578 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 122' ' ' GLU . 1.0 OUTLIER -61.36 -48.58 80.62 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.244 -0.91 . . . . 0.0 109.78 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -56.23 -20.42 18.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.921 . . . . 0.0 109.679 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.907 ' CE1' ' OE1' ' A' ' 119' ' ' GLU . 78.3 t80 -86.67 -50.69 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.169 -0.957 . . . . 0.0 109.269 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -73.7 -25.62 20.89 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -69.47 -51.83 32.35 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.174 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.3 t -63.81 -17.95 63.62 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.275 -0.89 . . . . 0.0 109.325 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -73.06 -42.11 63.43 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.238 -0.914 . . . . 0.0 109.265 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 34.9 mt -73.19 -51.13 18.94 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.276 -0.89 . . . . 0.0 109.099 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? . . . . . 0 N--CA 1.488 1.449 0 O-C-N 121.139 -0.976 . . . . 0.0 109.586 179.966 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 35' ' ' THR . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.724 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.621 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.578 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.801 HD22 HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.804 HG22 ' O ' ' A' ' 24' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.709 HG22 ' O ' ' A' ' 42' ' ' GLY . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.688 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.621 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.771 ' OH ' HG23 ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.544 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.709 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.446 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.591 ' O ' HG23 ' A' ' 53' ' ' THR . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.3 mm100 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.463 ' SG ' HD21 ' A' ' 120' ' ' LEU . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.521 ' H ' ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.553 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.825 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.633 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.825 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.714 ' HD3' HD13 ' A' ' 129' ' ' LEU . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.454 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.62 ' CG2' HD12 ' A' ' 114' ' ' ILE . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.441 HG23 ' CD2' ' A' ' 59' ' ' PHE . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 80' ' ' THR . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.525 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' THR . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.771 HG23 ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' ALA . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.415 ' OD2' HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 104' ' ' VAL . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.427 ' O ' HG12 ' A' ' 105' ' ' VAL . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.801 HD22 HD22 ' A' ' 15' ' ' ASN . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.62 HD12 ' CG2' ' A' ' 79' ' ' ILE . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.661 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.714 HD13 ' HD3' ' A' ' 75' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -140.95 118.24 11.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.302 -0.874 . . . . 0.0 109.344 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 1.614 HD11 ' CG1' ' A' ' 101' ' ' VAL . 15.0 tt -107.53 146.39 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.626 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.8 p30 -75.72 -51.99 11.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.083 -1.01 . . . . 0.0 110.829 -178.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.8 ' CD ' HG21 ' A' ' 104' ' ' VAL . 5.7 mttm 64.29 -43.06 0.28 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.296 -0.877 . . . . 0.0 109.797 -179.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.8 tm-20 -46.36 -38.83 9.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 109.843 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.9 -60.03 2.47 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.188 -0.945 . . . . 0.0 109.487 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -44.91 -69.65 0.13 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.377 -0.827 . . . . 0.0 110.159 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -45.45 -56.18 5.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.63 -43.96 69.14 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.189 -0.945 . . . . 0.0 110.253 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.657 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -78.01 -45.61 23.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.007 -1.058 . . . . 0.0 110.369 -179.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 3.0 m-30 -45.43 -55.2 6.37 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 110.249 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.724 HD22 ' ND2' ' A' ' 107' ' ' ASN . 0.3 OUTLIER -71.23 -21.64 62.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.062 -1.024 . . . . 0.0 109.803 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.7 tp -72.18 -41.2 67.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.215 -0.928 . . . . 0.0 109.872 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.657 HG13 ' O ' ' A' ' 13' ' ' ALA . 0.9 OUTLIER -69.82 -10.22 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 109.462 -179.754 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.491 ' NH2' ' OD1' ' A' ' 15' ' ' ASN . 10.0 ttm180 . . . . . 0 N--CA 1.489 1.51 0 O-C-N 121.239 -0.913 . . . . 0.0 109.306 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.411 0.624 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.541 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.5 OUTLIER -70.06 128.66 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.415 -0.803 . . . . 0.0 109.907 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.823 HG23 ' CD1' ' A' ' 26' ' ' TRP . 12.3 tt -61.89 -34.26 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.108 -0.995 . . . . 0.0 108.757 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.823 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.1 p-90 -160.29 151.96 19.86 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.268 -0.895 . . . . 0.0 109.386 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.6 m -119.22 141.67 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.442 -0.786 . . . . 0.0 109.355 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.586 ' HB ' HD13 ' A' ' 58' ' ' LEU . 41.3 p -131.99 136.31 47.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.863 . . . . 0.0 109.547 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.496 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.36 163.86 15.72 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.452 ' O ' ' C ' ' A' ' 31' ' ' TYR . 10.6 ptm180 -140.81 147.76 39.54 Favored 'General case' 0 C--N 1.289 -2.029 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.443 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.661 ' OH ' ' OD1' ' A' ' 97' ' ' ASP . 3.9 m-85 -39.85 98.68 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.73 -0.607 . . . . 0.0 110.241 -178.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 1.184 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -96.86 101.42 13.0 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.554 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 51.5 -119.89 9.09 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 108.683 -1.767 . . . . 0.0 108.683 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.96 21.58 17.33 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.364 -1.08 . . . . 0.0 110.095 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 1.184 ' O ' ' OD1' ' A' ' 32' ' ' ASP . 1.4 m -142.3 133.1 25.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 109.781 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.478 HD11 ' CE1' ' A' ' 31' ' ' TYR . 1.6 mp -80.64 110.56 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.349 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.932 HG13 ' OD1' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -135.5 153.49 77.76 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.358 -0.839 . . . . 0.0 109.63 -179.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 37' ' ' VAL . 86.4 Cg_exo -33.84 146.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.993 2.462 . . . . 0.0 112.316 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.2 -26.36 0.15 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.545 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -142.89 -178.56 5.87 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.421 -1.046 . . . . 0.0 109.466 -179.475 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.825 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -160.44 177.64 10.36 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 121.746 0.784 . . . . 0.0 110.736 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.758 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -163.69 135.82 3.97 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -108.03 -5.44 17.06 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -159.02 175.4 13.58 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -11.24 60.0 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.17 -0.956 . . . . 0.0 109.527 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -78.14 -31.77 49.98 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.936 -1.103 . . . . 0.0 110.149 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -42.9 91.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.002 -1.061 . . . . 0.0 109.549 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.587 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -55.83 -31.22 62.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.342 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.45 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.3 mt -83.2 -13.96 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.016 -1.052 . . . . 0.0 109.999 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -87.18 -52.53 5.36 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.612 -1.305 . . . . 0.0 109.77 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.583 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -100.74 55.05 0.86 Allowed 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 110.896 -178.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.9 t -154.0 67.14 0.73 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.003 -1.06 . . . . 0.0 109.64 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.59 ' C ' ' H ' ' A' ' 55' ' ' ASP . 7.6 p -84.44 154.9 22.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.248 -0.907 . . . . 0.0 110.003 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER -58.05 8.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.478 -0.763 . . . . 0.0 110.482 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.59 ' H ' ' C ' ' A' ' 53' ' ' THR . 2.5 m-20 -109.95 26.78 10.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 0.0 109.366 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.555 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.8 OUTLIER -147.27 148.0 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 109.63 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.581 ' NH2' ' O ' ' A' ' 83' ' ' GLY . 3.2 ptp180 -130.47 133.61 46.43 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 110.329 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.775 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.0 pp -172.63 179.51 2.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.698 . . . . 0.0 109.279 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.513 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.77 154.24 27.71 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.044 -1.035 . . . . 0.0 109.162 179.814 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.423 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -139.39 159.14 42.85 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.015 -1.053 . . . . 0.0 109.294 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 15.0 t80 -148.5 107.56 3.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.641 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -121.48 153.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.339 -0.85 . . . . 0.0 109.641 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -87.08 108.39 18.86 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -90.2 155.5 18.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.278 -0.888 . . . . 0.0 109.927 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.417 ' H ' HG22 ' A' ' 65' ' ' THR . 1.0 OUTLIER -80.74 140.04 35.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 108.809 179.339 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.141 -0.974 . . . . 0.0 109.547 -179.891 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.659 ' HG2' HD22 ' A' ' 129' ' ' LEU . 14.5 tptm -105.22 153.84 21.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 109.751 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.471 ' O ' ' N ' ' A' ' 109' ' ' ALA . 78.6 m-85 -126.88 120.47 29.3 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.492 -0.755 . . . . 0.0 109.371 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.18 160.4 41.5 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.003 . . . . 0.0 110.496 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.8 tt -108.78 158.0 18.05 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.4 mt -138.31 143.64 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 120.931 -1.105 . . . . 0.0 108.928 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.22 120.26 41.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.193 -0.942 . . . . 0.0 109.696 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . 0.555 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 61.1 t-105 -93.15 112.02 23.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.136 -0.977 . . . . 0.0 109.611 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.1 93.24 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 108.807 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.581 ' O ' ' NH2' ' A' ' 57' ' ' ARG . . . -64.67 160.4 41.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 54' ' ' ASP . 2.4 mm-40 -121.13 71.43 0.95 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.617 -0.931 . . . . 0.0 109.766 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.513 ' O ' ' O ' ' A' ' 86' ' ' VAL . 0.4 OUTLIER -178.12 -24.93 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.05 -1.031 . . . . 0.0 110.067 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.513 ' O ' ' O ' ' A' ' 85' ' ' ASP . 1.9 t -59.51 -134.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.064 -1.022 . . . . 0.0 109.787 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.7 m -125.93 -177.73 4.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.507 -0.746 . . . . 0.0 110.121 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.15 -18.04 63.65 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.903 -1.279 . . . . 0.0 109.903 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mp -47.69 -57.05 6.01 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.186 -1.184 . . . . 0.0 109.864 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.497 ' O ' ' N ' ' A' ' 94' ' ' THR . 1.0 OUTLIER -62.37 -31.38 72.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.192 -0.942 . . . . 0.0 109.729 -179.708 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 4.5 tpt180 -45.09 -65.79 0.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.753 -1.217 . . . . 0.0 110.042 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.61 -33.4 66.66 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.146 -0.971 . . . . 0.0 110.235 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.527 ' HG3' ' HH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -69.47 -58.66 3.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.132 -0.98 . . . . 0.0 109.87 -179.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.497 ' N ' ' O ' ' A' ' 90' ' ' GLN . 3.5 m -44.64 -36.4 3.07 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.144 -0.972 . . . . 0.0 109.362 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -57.53 -57.1 21.55 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 m -66.45 -47.28 73.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.956 -1.32 . . . . 0.0 111.143 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.661 ' OD1' ' OH ' ' A' ' 31' ' ' TYR . 3.0 m-20 -69.17 -43.27 74.58 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.745 -1.222 . . . . 0.0 111.434 -177.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.88 -26.11 33.48 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.68 -1.262 . . . . 0.0 108.702 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.5 m -75.66 -29.85 59.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.318 -0.864 . . . . 0.0 108.917 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.7 -58.47 5.03 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 1.614 ' CG1' HD11 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -65.85 -25.92 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.122 -0.986 . . . . 0.0 110.441 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.5 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.4 tttp -70.68 -37.99 73.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.06 -1.025 . . . . 0.0 109.945 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.456 ' C ' ' H ' ' A' ' 105' ' ' VAL . 27.6 tt0 -79.26 -37.35 38.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.528 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.8 HG21 ' CD ' ' A' ' 7' ' ' LYS . 2.9 p -73.19 18.56 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.016 -1.053 . . . . 0.0 110.029 -179.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 102' ' ' LYS . 4.5 p -98.31 133.5 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.107 -0.996 . . . . 0.0 109.635 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.49 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -138.8 31.15 2.26 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.382 -0.969 . . . . 0.0 108.382 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.724 ' ND2' HD22 ' A' ' 15' ' ' ASN . 17.4 m-20 -136.09 -22.95 1.35 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.611 -0.68 . . . . 0.0 110.118 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PHE . . . . . 0.572 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -81.92 168.35 18.0 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.957 -1.089 . . . . 0.0 110.281 -179.491 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -109.07 -29.33 8.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.566 -0.709 . . . . 0.0 109.166 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -162.28 151.74 15.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 109.404 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.97 154.28 20.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.324 -0.86 . . . . 0.0 109.244 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -136.46 159.13 42.71 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.268 -0.895 . . . . 0.0 109.9 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.6 p -121.67 144.23 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.561 HG22 ' H ' ' A' ' 116' ' ' ASP . 4.7 mm -129.13 158.51 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.166 -0.959 . . . . 0.0 110.172 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.484 ' N ' HG22 ' A' ' 114' ' ' ILE . 88.8 p -138.73 2.2 2.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.561 ' H ' HG22 ' A' ' 114' ' ' ILE . 4.1 m-20 -145.35 154.1 41.95 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.881 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.9 ttp180 -73.56 -31.36 63.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.215 -0.928 . . . . 0.0 109.856 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.78 -6.99 54.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.129 -0.982 . . . . 0.0 109.483 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.599 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 4.4 mm-40 -86.45 3.54 43.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.103 -0.998 . . . . 0.0 109.778 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.442 HD13 ' CE1' ' A' ' 48' ' ' PHE . 2.4 mt -105.97 13.95 28.61 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 109.001 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -64.62 148.54 50.68 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.514 -0.741 . . . . 0.0 109.793 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.25 -51.78 68.49 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.187 -0.946 . . . . 0.0 109.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -55.25 -21.92 16.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 109.738 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 66.3 t80 -84.83 -49.07 8.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.88 . . . . 0.0 109.143 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -69.32 -12.45 16.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -82.37 -50.31 9.05 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.145 -0.972 . . . . 0.0 109.644 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -24.13 67.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.221 -0.925 . . . . 0.0 110.458 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 129' ' ' LEU . 15.3 pt-20 -85.3 -39.77 17.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.96 -1.088 . . . . 0.0 109.713 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.659 HD22 ' HG2' ' A' ' 75' ' ' LYS . 5.4 mt -75.3 -36.26 61.17 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.121 -0.987 . . . . 0.0 108.664 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.491 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.556 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 41.1 mtt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.329 0.585 . . . . 0.0 109.505 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 67.16 -68.25 0.15 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.207 -0.933 . . . . 0.0 109.51 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.556 HG21 ' OD1' ' A' ' 97' ' ' ASP . 19.7 m -158.96 146.06 17.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.229 -0.919 . . . . 0.0 109.527 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.28 118.36 18.45 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.415 -0.803 . . . . 0.0 109.079 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -107.57 139.62 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.333 -0.854 . . . . 0.0 109.89 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.591 ' O ' ' N ' ' A' ' 8' ' ' GLU . 46.9 t0 -100.54 35.71 2.07 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.273 -0.892 . . . . 0.0 108.989 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.725 ' HD2' HG11 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -43.63 -16.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.206 -0.933 . . . . 0.0 109.4 -179.62 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.591 ' N ' ' O ' ' A' ' 6' ' ' ASP . 5.3 tt0 -54.11 -40.54 67.39 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.168 -0.957 . . . . 0.0 108.823 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -68.22 -63.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.384 -0.822 . . . . 0.0 108.804 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.647 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.2 m -44.65 -53.28 7.38 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.294 -0.879 . . . . 0.0 109.009 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 10' ' ' CYS . 20.6 ttt180 -43.55 -59.73 2.05 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.099 -1.0 . . . . 0.0 109.456 -179.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.42 -40.79 2.68 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.389 -0.819 . . . . 0.0 109.556 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.86 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -86.46 -35.9 19.38 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.088 -1.008 . . . . 0.0 110.018 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.576 ' CE1' ' CZ ' ' A' ' 61' ' ' PHE . 1.2 t80 -45.44 -67.95 0.24 Allowed 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.431 -0.793 . . . . 0.0 110.36 -179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.643 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 0.4 OUTLIER -75.69 -32.74 60.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.356 -0.84 . . . . 0.0 110.746 -178.72 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.741 HD21 ' OG ' ' A' ' 22' ' ' SER . 12.6 tp -69.13 -27.89 65.97 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.749 -1.22 . . . . 0.0 109.146 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.86 HG23 ' O ' ' A' ' 13' ' ' ALA . 22.5 t -58.66 -1.65 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.539 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.9 OUTLIER -110.35 1.14 18.27 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.264 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.57 159.84 16.99 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.293 -0.88 . . . . 0.0 109.412 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -92.52 22.29 4.75 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.202 -0.936 . . . . 0.0 108.864 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.44 ' O ' ' C ' ' A' ' 22' ' ' SER . . . -109.66 -84.63 1.57 Allowed Glycine 0 N--CA 1.489 2.173 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.741 ' OG ' HD21 ' A' ' 16' ' ' LEU . 0.9 OUTLIER -41.02 -53.89 2.89 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.054 -1.262 . . . . 0.0 110.534 -178.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.704 ' HB3' ' O ' ' A' ' 22' ' ' SER . . . 77.94 -15.37 0.76 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.239 -0.913 . . . . 0.0 109.799 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.651 ' O ' HG13 ' A' ' 24' ' ' VAL . 6.9 p -46.44 91.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.992 -1.067 . . . . 0.0 108.932 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.5 tt -43.98 -54.07 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 121.25 -0.906 . . . . 0.0 109.7 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.653 ' CZ3' HG23 ' A' ' 28' ' ' THR . 41.8 p-90 -143.99 166.71 24.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.505 -1.372 . . . . 0.0 111.498 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.582 HG21 ' HB3' ' A' ' 13' ' ' ALA . 4.1 m -136.34 138.84 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.602 -0.686 . . . . 0.0 109.4 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.653 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 46.8 p -125.87 141.14 52.13 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.308 -0.87 . . . . 0.0 110.173 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.647 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.21 160.89 25.6 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.662 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -137.87 146.69 43.69 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 121.243 -0.911 . . . . 0.0 109.59 -179.598 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.567 ' CZ ' ' OG1' ' A' ' 94' ' ' THR . 4.7 m-85 -59.75 98.5 0.05 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.462 -0.774 . . . . 0.0 110.019 -179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.574 ' OD1' ' N ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -94.97 102.16 13.97 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.375 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 72.97 -119.84 7.0 Favored Glycine 0 N--CA 1.485 1.934 0 N-CA-C 108.789 -1.725 . . . . 0.0 108.789 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.2 26.89 10.1 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.325 -1.103 . . . . 0.0 110.615 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.484 ' C ' HD12 ' A' ' 36' ' ' ILE . 8.3 m -145.57 151.17 37.7 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.854 -1.154 . . . . 0.0 110.686 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.656 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.8 mp -101.55 107.22 21.03 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.44 HG22 ' CG ' ' A' ' 32' ' ' ASP . 0.9 OUTLIER -135.7 151.81 74.95 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.292 -0.88 . . . . 0.0 110.018 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.2 Cg_exo -31.88 139.08 0.05 OUTLIER 'Trans proline' 0 C--N 1.313 -1.336 0 C-N-CA 123.069 2.513 . . . . 0.0 112.391 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.12 -35.56 0.21 Allowed Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.615 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.7 m-20 -142.71 -179.02 6.07 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.806 -0.82 . . . . 0.0 108.878 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.864 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -159.25 -170.19 2.89 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.368 -0.832 . . . . 0.0 110.138 -179.778 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.18 140.62 6.31 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.42 -4.78 15.4 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.063 -1.458 . . . . 0.0 107.063 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.04 175.22 13.79 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.429 ' O ' ' C ' ' A' ' 46' ' ' GLN . 1.3 t80 -72.18 -46.29 56.94 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 120.996 -1.065 . . . . 0.0 109.355 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.437 ' N ' HE21 ' A' ' 46' ' ' GLN . 14.6 mm-40 -42.22 -29.38 0.24 Allowed 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.294 -0.879 . . . . 0.0 110.077 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.746 ' CE1' HE22 ' A' ' 41' ' ' GLN . 2.7 t-160 -66.62 -47.91 71.14 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.073 -1.017 . . . . 0.0 109.135 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -42.97 -28.0 0.23 Allowed 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 179.702 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.442 ' C ' ' H ' ' A' ' 51' ' ' GLN . 1.9 mt -75.39 -45.56 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.371 -0.83 . . . . 0.0 110.605 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -81.4 8.34 9.55 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 106.771 -1.566 . . . . 0.0 106.771 179.064 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.615 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -119.82 -22.3 6.86 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.773 -1.103 . . . . 0.0 110.257 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.518 ' O ' HG23 ' A' ' 53' ' ' THR . 0.1 OUTLIER -69.35 141.08 54.29 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.206 -0.934 . . . . 0.0 109.298 179.73 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 52' ' ' CYS . 33.0 p -157.43 114.19 2.97 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.594 -0.842 . . . . 0.0 110.741 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.569 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.5 OUTLIER -64.11 -0.53 1.21 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.434 ' H ' ' C ' ' A' ' 53' ' ' THR . 10.1 m-20 -110.12 19.12 19.29 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.448 -0.783 . . . . 0.0 109.373 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG1' ' OG1' ' A' ' 53' ' ' THR . 0.3 OUTLIER -144.13 166.18 13.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 O-C-N 121.165 -0.959 . . . . 0.0 110.158 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.718 HH12 ' N ' ' A' ' 91' ' ' ARG . 8.4 ptp180 -136.92 136.43 38.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.803 -0.759 . . . . 0.0 109.885 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.729 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.8 pp -172.31 166.59 5.86 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.395 -0.816 . . . . 0.0 109.692 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.516 ' O ' HG22 ' A' ' 28' ' ' THR . 31.4 m-85 -100.01 156.9 16.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.056 -1.028 . . . . 0.0 108.801 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.506 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -127.64 152.62 47.45 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.187 -0.946 . . . . 0.0 108.99 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.576 ' CZ ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -146.19 96.11 2.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.283 -0.886 . . . . 0.0 109.254 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -121.3 151.64 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.074 -1.016 . . . . 0.0 109.76 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.514 ' CZ ' ' OG ' ' A' ' 74' ' ' SER . 12.5 ttp180 -92.68 117.57 30.13 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -99.44 155.71 17.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.178 -0.951 . . . . 0.0 110.142 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 m -77.77 146.57 35.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.42 -0.8 . . . . 0.0 108.975 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.7 m -109.74 -27.34 9.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.829 . . . . 0.0 109.49 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 49.44 46.39 36.59 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -171.94 -78.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.202 -1.175 . . . . 0.0 109.537 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.515 ' C ' ' H ' ' A' ' 71' ' ' SER . . . -56.58 100.55 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.189 -0.945 . . . . 0.0 109.468 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.0 ptt? -54.63 -5.02 0.07 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.273 -0.892 . . . . 0.0 109.504 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.531 ' C ' ' H ' ' A' ' 73' ' ' ARG . 37.1 m -60.08 103.42 0.22 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.287 -0.883 . . . . 0.0 109.511 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER 53.78 4.94 0.05 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.273 -0.892 . . . . 0.0 109.449 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.531 ' H ' ' C ' ' A' ' 71' ' ' SER . 17.9 mtp180 42.92 70.26 0.31 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.281 -0.887 . . . . 0.0 109.485 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 1.2 m 164.23 144.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.251 -0.906 . . . . 0.0 109.525 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 3.9 tptp -105.3 161.84 13.94 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.353 -0.842 . . . . 0.0 109.711 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -133.09 124.46 27.62 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.429 -0.794 . . . . 0.0 109.449 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.92 159.39 43.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 110.839 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.71 ' O ' HD12 ' A' ' 79' ' ' ILE . 8.6 tp -111.25 150.04 30.16 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.71 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.5 mp -128.97 144.03 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 120.998 -1.064 . . . . 0.0 109.329 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.7 m -105.19 137.25 43.27 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.296 -0.877 . . . . 0.0 109.944 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.2 t-105 -114.76 110.62 19.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.392 -0.817 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -105.95 93.49 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.16 -0.962 . . . . 0.0 109.119 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.93 155.73 29.84 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 54' ' ' ASP . 5.6 tp10 -105.92 42.9 1.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.458 -1.025 . . . . 0.0 109.521 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -161.84 19.17 0.11 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.167 -0.958 . . . . 0.0 109.613 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.567 HG21 ' HE ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -92.41 164.6 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.089 -1.007 . . . . 0.0 109.63 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.7 p -67.7 169.92 8.72 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.43 -0.794 . . . . 0.0 109.703 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.28 -16.65 66.35 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.3 mt -61.4 -70.24 0.2 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.17 -1.194 . . . . 0.0 110.347 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.437 ' HB2' HH11 ' A' ' 57' ' ' ARG . 1.4 mt-30 -52.4 -26.99 14.0 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.366 -0.834 . . . . 0.0 109.924 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.718 ' N ' HH12 ' A' ' 57' ' ' ARG . 0.5 OUTLIER -52.39 -59.5 4.35 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.046 . . . . 0.0 109.744 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.46 -23.31 66.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 109.823 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.437 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 4.0 tptp -74.91 -48.47 24.54 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.132 -0.98 . . . . 0.0 109.228 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.567 ' OG1' ' CZ ' ' A' ' 31' ' ' TYR . 13.2 m -46.01 -45.93 16.18 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.218 -0.926 . . . . 0.0 109.27 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -54.53 -58.54 12.79 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.129 -1.188 . . . . 0.0 110.129 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 88.2 m -64.76 -47.31 78.64 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.037 -1.272 . . . . 0.0 111.132 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.573 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -71.95 -43.63 64.89 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.771 -1.205 . . . . 0.0 111.612 -177.574 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -54.58 -26.19 30.85 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 120.668 -1.27 . . . . 0.0 109.127 -179.433 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -79.48 -27.36 41.54 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.294 -0.879 . . . . 0.0 108.639 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 97' ' ' ASP . 1.9 mt -68.82 -59.22 3.24 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.508 -0.745 . . . . 0.0 109.607 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 3.0 p -62.46 -29.33 46.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.183 -0.948 . . . . 0.0 110.037 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -66.53 -38.16 86.57 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.152 -0.968 . . . . 0.0 109.663 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -67.42 -24.19 65.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.23 -0.919 . . . . 0.0 109.617 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.725 HG11 ' HD2' ' A' ' 7' ' ' LYS . 20.4 t -86.79 30.27 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.224 -0.922 . . . . 0.0 109.667 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.7 p -95.17 126.5 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.138 -0.977 . . . . 0.0 109.765 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.455 ' C ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -151.7 22.84 0.69 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.323 -0.861 . . . . 0.0 109.943 -179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.643 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -148.46 39.92 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.997 -1.064 . . . . 0.0 110.026 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.539 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -149.15 -165.71 2.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.925 -1.11 . . . . 0.0 110.596 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.426 ' N ' ' CG ' ' A' ' 108' ' ' PHE . . . -118.14 -50.55 2.46 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.747 -0.595 . . . . 0.0 109.773 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.579 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -158.7 157.1 31.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.101 -0.999 . . . . 0.0 109.952 -179.722 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.588 ' OE1' ' N ' ' A' ' 112' ' ' PHE . 0.0 OUTLIER -104.87 159.79 15.52 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.465 -0.772 . . . . 0.0 108.968 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.588 ' N ' ' OE1' ' A' ' 111' ' ' GLU . 23.6 m-85 -136.15 161.72 34.93 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.183 -0.948 . . . . 0.0 109.772 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 80.6 t -121.36 150.38 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.51 HG22 ' N ' ' A' ' 115' ' ' SER . 56.3 mt -138.65 161.06 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.238 -0.914 . . . . 0.0 110.182 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.51 ' N ' HG22 ' A' ' 114' ' ' ILE . 0.3 OUTLIER -141.18 6.3 1.94 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.347 -0.845 . . . . 0.0 109.311 179.449 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -150.95 155.41 39.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.035 -1.04 . . . . 0.0 109.924 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -70.53 -31.96 69.24 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.262 -0.899 . . . . 0.0 109.599 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -67.77 -16.67 64.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.152 -0.967 . . . . 0.0 108.99 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.594 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.0 OUTLIER -86.54 1.64 50.9 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.339 -0.851 . . . . 0.0 109.763 -179.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.566 HD13 ' CD1' ' A' ' 48' ' ' PHE . 6.5 mt -97.49 20.17 12.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.199 -0.938 . . . . 0.0 108.87 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -74.84 152.72 38.92 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.552 -0.718 . . . . 0.0 109.883 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.98 -48.65 57.39 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.19 -0.944 . . . . 0.0 109.844 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -12.32 7.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.063 -1.023 . . . . 0.0 109.744 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.594 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 9.4 t80 -86.58 -49.07 7.81 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.938 0.875 . . . . 0.0 109.371 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 3.4 mt -74.8 -26.35 19.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.729 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.575 ' NE ' ' HZ1' ' A' ' 130' ' ' LYS . 29.9 ttt180 -68.59 -54.57 15.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.21 -0.931 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 4.9 t -63.77 -15.8 59.57 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.345 -0.847 . . . . 0.0 109.663 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.545 ' CD ' ' CD1' ' A' ' 112' ' ' PHE . 2.2 tt0 -76.6 -39.99 50.84 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 109.246 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 12.8 mt -73.34 -48.06 37.37 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.229 -0.919 . . . . 0.0 109.244 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.575 ' HZ1' ' NE ' ' A' ' 126' ' ' ARG . 13.7 mttt -49.38 -24.15 1.8 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.116 -0.99 . . . . 0.0 109.376 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 132' ' ' ALA . 1.1 mtmm -72.1 -70.5 0.33 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.208 -0.932 . . . . 0.0 109.33 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 131' ' ' LYS . . . 42.48 62.72 1.62 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.262 -0.899 . . . . 0.0 109.49 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 134' ' ' GLY . . . -163.49 56.39 0.28 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 133' ' ' GLY . . . -43.02 123.07 3.75 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.458 ' C ' ' H ' ' A' ' 137' ' ' TYR . . . -137.08 10.86 3.06 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.333 -1.098 . . . . 0.0 109.487 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.24 0.56 0.42 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.235 -0.916 . . . . 0.0 109.392 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.458 ' H ' ' C ' ' A' ' 135' ' ' ALA . 1.8 t80 -48.35 -41.03 27.38 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.203 -0.936 . . . . 0.0 109.495 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.44 1.59 11.45 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.289 -0.882 . . . . 0.0 109.492 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -94.81 9.86 37.48 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.241 -0.912 . . . . 0.0 109.472 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 51.88 37.96 22.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.288 -0.883 . . . . 0.0 109.471 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 63.36 -177.71 0.15 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.235 -0.915 . . . . 0.0 109.465 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.02 -0.991 . . . . 0.0 109.468 -179.931 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.459 ' O ' ' O ' ' A' ' 2' ' ' ALA . 32.1 mtt . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 1' ' ' MET . . . 60.74 144.88 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 109.486 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.768 HG21 ' OD1' ' A' ' 97' ' ' ASP . 2.7 m -138.75 147.15 42.3 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.299 -0.875 . . . . 0.0 109.471 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.473 ' CB ' HG23 ' A' ' 35' ' ' THR . 59.7 mttt -135.26 118.32 16.43 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.353 -0.842 . . . . 0.0 109.403 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -107.76 141.23 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.398 -0.814 . . . . 0.0 109.733 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -100.69 70.11 1.41 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -0.917 . . . . 0.0 109.528 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.769 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -58.98 -24.49 62.74 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.243 -0.911 . . . . 0.0 109.494 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -52.99 -46.06 68.14 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.245 -0.909 . . . . 0.0 109.449 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -67.47 0.44 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.549 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.82 -63.0 1.01 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.935 . . . . 0.0 109.845 -179.665 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 10.5 ttp180 -44.59 -56.26 4.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.909 -1.12 . . . . 0.0 109.678 -179.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.44 -54.8 27.44 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.188 -0.945 . . . . 0.0 109.908 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -66.65 -43.72 83.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.134 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.54 ' CZ ' ' CB ' ' A' ' 61' ' ' PHE . 3.2 m-85 -46.8 -55.24 8.24 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.336 -0.852 . . . . 0.0 110.312 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.717 HD22 ' ND2' ' A' ' 107' ' ' ASN . 0.4 OUTLIER -78.94 -28.42 43.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.243 -0.911 . . . . 0.0 110.697 -178.703 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.405 ' HA ' HD12 ' A' ' 16' ' ' LEU . 33.7 tp -56.49 -19.29 14.68 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.792 -1.192 . . . . 0.0 109.473 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 13' ' ' ALA . 1.5 m -77.58 -2.84 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.226 -0.921 . . . . 0.0 109.415 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.722 HH12 ' NH1' ' A' ' 73' ' ' ARG . 11.1 mtm180 -77.83 15.39 0.87 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -93.94 -156.97 0.52 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.89 . . . . 0.0 109.593 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -101.76 49.07 0.87 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.199 -0.938 . . . . 0.0 109.496 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.37 57.63 5.48 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -130.39 7.21 4.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.474 -1.015 . . . . 0.0 109.521 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -128.0 -162.12 1.15 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.39 -0.819 . . . . 0.0 109.919 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.733 HG21 ' CG1' ' A' ' 27' ' ' VAL . 13.9 m -78.4 122.88 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.437 -0.789 . . . . 0.0 109.649 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.859 HG23 ' CD1' ' A' ' 26' ' ' TRP . 14.0 tt -49.96 -34.27 9.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 120.894 -1.129 . . . . 0.0 108.4 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.859 ' CD1' HG23 ' A' ' 25' ' ' ILE . 37.0 p-90 -160.95 171.57 18.46 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.259 -0.9 . . . . 0.0 109.402 177.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.733 ' CG1' HG21 ' A' ' 24' ' ' VAL . 34.7 m -137.0 143.59 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.249 -0.907 . . . . 0.0 109.287 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.599 HG23 ' CE3' ' A' ' 26' ' ' TRP . 46.0 p -132.47 134.71 45.4 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.293 -0.879 . . . . 0.0 109.701 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.421 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -123.61 153.97 39.95 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -131.71 150.18 52.24 Favored 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.521 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.752 ' OH ' HG23 ' A' ' 94' ' ' THR . 1.8 m-85 -55.04 99.28 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.569 -0.707 . . . . 0.0 110.443 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.87 101.08 13.16 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.864 -1.162 . . . . 0.0 107.864 178.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 65.49 -117.32 9.89 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 108.951 -1.659 . . . . 0.0 108.951 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.8 25.64 11.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.31 -1.112 . . . . 0.0 110.113 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -145.42 150.16 36.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.226 -0.921 . . . . 0.0 109.73 179.735 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.6 mt -104.15 108.44 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.334 -0.854 . . . . 0.0 108.989 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.9 m -135.49 158.76 73.74 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.254 -0.904 . . . . 0.0 109.724 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 87.6 Cg_exo -30.08 142.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 123.493 2.795 . . . . 0.0 112.689 179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -140.55 -30.67 0.17 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.462 ' OD1' ' OE1' ' A' ' 51' ' ' GLN . 0.3 OUTLIER -142.5 -178.9 5.99 Favored 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.625 -0.926 . . . . 0.0 109.263 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.786 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -162.69 175.68 11.1 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.871 -178.678 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.773 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.14 137.26 4.65 Favored Glycine 0 N--CA 1.486 1.977 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.78 -3.42 20.45 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -161.0 177.54 10.25 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -77.37 -10.58 59.54 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 120.883 -1.135 . . . . 0.0 109.218 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.511 ' N ' HE21 ' A' ' 46' ' ' GLN . 7.3 mm-40 -74.99 -36.68 61.99 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.049 -1.032 . . . . 0.0 110.255 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.546 ' O ' ' N ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -62.89 -53.3 56.32 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.966 -1.084 . . . . 0.0 109.569 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.572 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -45.45 -28.02 0.82 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.188 -0.945 . . . . 0.0 108.72 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.455 HG12 ' CE2' ' A' ' 48' ' ' PHE . 0.8 OUTLIER -83.93 -17.01 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.272 -0.892 . . . . 0.0 110.134 179.405 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' A' ' 47' ' ' HIS . 5.3 tt0 -81.73 -54.45 5.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.775 -1.203 . . . . 0.0 109.176 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.593 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -72.47 -12.13 60.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.427 -0.795 . . . . 0.0 109.736 179.809 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.411 ' C ' ' O ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -42.94 126.28 3.78 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.279 -0.888 . . . . 0.0 109.637 -179.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.521 ' C ' ' H ' ' A' ' 55' ' ' ASP . 5.6 p -150.62 110.49 4.08 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.873 0.844 . . . . 0.0 110.608 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -57.38 0.35 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.786 -0.571 . . . . 0.0 110.039 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.521 ' H ' ' C ' ' A' ' 53' ' ' THR . 50.7 t0 -109.05 31.86 5.38 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 109.56 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -148.37 168.31 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.022 -1.049 . . . . 0.0 110.477 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.644 HH12 ' N ' ' A' ' 91' ' ' ARG . 5.4 ptp180 -141.95 134.91 28.81 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.274 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.77 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.71 168.94 5.08 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.334 -0.854 . . . . 0.0 109.621 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.8 OUTLIER -108.71 160.56 15.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.128 -0.982 . . . . 0.0 109.003 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -140.47 157.37 45.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.93 -1.106 . . . . 0.0 109.365 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.54 ' CB ' ' CZ ' ' A' ' 14' ' ' TYR . 37.1 t80 -148.48 104.2 3.48 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.278 -0.889 . . . . 0.0 109.221 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -120.07 153.38 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.356 -0.84 . . . . 0.0 109.447 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.495 ' NE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ttp180 -88.36 108.58 19.42 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.476 -0.765 . . . . 0.0 109.049 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -89.24 155.69 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.339 -0.85 . . . . 0.0 109.794 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' HG23 ' A' ' 65' ' ' THR . 13.9 t -86.16 128.35 34.87 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.259 -0.901 . . . . 0.0 108.882 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -133.61 135.02 43.95 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.345 -0.847 . . . . 0.0 109.556 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.21 -40.62 1.5 Allowed Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.517 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 0.3 OUTLIER 58.22 9.3 0.96 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.235 -1.156 . . . . 0.0 109.487 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.502 ' C ' ' H ' ' A' ' 71' ' ' SER . . . -102.73 150.32 23.58 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.296 -0.877 . . . . 0.0 109.482 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 7.4 mtt -71.66 36.35 0.06 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.182 -0.949 . . . . 0.0 109.496 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.502 ' H ' ' C ' ' A' ' 69' ' ' ALA . 69.8 m -101.17 -48.81 4.28 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.873 . . . . 0.0 109.428 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 8.1 mtmt -100.79 -127.69 0.2 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.203 -0.936 . . . . 0.0 109.481 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.722 ' NH1' HH12 ' A' ' 18' ' ' ARG . 0.3 OUTLIER -173.58 69.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.228 -0.92 . . . . 0.0 109.392 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.495 ' CB ' ' NE ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER 56.93 160.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.304 -0.873 . . . . 0.0 109.391 -179.946 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.404 ' NZ ' ' HB1' ' A' ' 109' ' ' ALA . 29.7 tptt -104.83 154.81 19.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.253 -0.904 . . . . 0.0 109.564 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -127.58 122.28 32.79 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.434 -0.791 . . . . 0.0 109.651 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.496 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -144.62 167.27 22.94 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.233 -0.917 . . . . 0.0 110.64 -179.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.952 ' O ' HD12 ' A' ' 79' ' ' ILE . 5.5 tt -122.6 157.98 30.96 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.952 HD12 ' O ' ' A' ' 78' ' ' LEU . 1.3 mp -136.09 149.62 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 120.96 -1.088 . . . . 0.0 108.626 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 1.002 HG21 ' NZ ' ' A' ' 98' ' ' LYS . 55.7 m -112.66 120.09 40.34 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.515 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 64.1 t-105 -95.18 111.87 23.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.124 -0.985 . . . . 0.0 109.853 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.0 mm -108.9 93.2 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 108.673 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.32 153.76 35.05 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -104.03 43.24 1.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.481 -1.011 . . . . 0.0 109.713 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.87 11.82 0.49 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.128 -0.982 . . . . 0.0 109.743 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.474 HG12 ' N ' ' A' ' 87' ' ' SER . 46.9 t -89.16 160.19 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.122 -0.986 . . . . 0.0 109.668 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.474 ' N ' HG12 ' A' ' 86' ' ' VAL . 0.4 OUTLIER -68.32 -176.96 0.81 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.433 -0.792 . . . . 0.0 109.796 -179.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.21 -16.53 66.79 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.6 mp -56.83 -70.04 0.13 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.167 -1.196 . . . . 0.0 110.239 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.605 ' CB ' HH11 ' A' ' 57' ' ' ARG . 76.9 mm-40 -60.04 -18.83 49.31 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.197 -0.94 . . . . 0.0 110.181 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.649 HH11 ' CG ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -55.25 -58.36 8.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.797 -1.189 . . . . 0.0 109.604 -179.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.89 -25.2 32.72 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.203 -0.936 . . . . 0.0 109.747 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.551 ' NZ ' ' OG1' ' A' ' 3' ' ' THR . 0.1 OUTLIER -72.11 -27.13 62.44 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.308 -0.87 . . . . 0.0 109.075 179.64 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.752 HG23 ' OH ' ' A' ' 31' ' ' TYR . 2.2 m -76.81 -52.1 10.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.396 -0.815 . . . . 0.0 109.106 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.451 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -41.77 -51.86 4.79 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.62 -56.53 9.04 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -1.15 . . . . 0.0 110.125 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.768 ' OD1' HG21 ' A' ' 3' ' ' THR . 84.4 m-20 -44.82 -37.95 4.19 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.13 -0.982 . . . . 0.0 110.52 -179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 1.002 ' NZ ' HG21 ' A' ' 80' ' ' THR . 0.2 OUTLIER -59.39 -43.36 92.96 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 120.775 -1.203 . . . . 0.0 108.193 179.357 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.4 m -46.83 -35.03 5.86 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.108 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.5 mt -71.18 -57.66 4.29 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.621 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 p -67.9 -13.68 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.169 -0.957 . . . . 0.0 110.052 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.403 ' O ' HG12 ' A' ' 105' ' ' VAL . 0.2 OUTLIER -81.85 -42.51 19.51 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.166 -0.959 . . . . 0.0 110.363 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.66 -25.41 30.77 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.035 -1.041 . . . . 0.0 110.952 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.482 HG21 ' HG2' ' A' ' 7' ' ' LYS . 3.2 p -81.03 -34.09 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 120.805 -1.185 . . . . 0.0 110.169 -179.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.432 ' C ' ' O ' ' A' ' 104' ' ' VAL . 7.5 p -42.99 134.09 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.031 -1.043 . . . . 0.0 109.621 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.492 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 4.9 pt20 -141.03 26.6 2.02 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.717 ' ND2' HD22 ' A' ' 15' ' ' ASN . 96.3 m-20 -144.51 39.72 1.29 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.498 -0.751 . . . . 0.0 109.603 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -142.0 149.09 39.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.1 -1.0 . . . . 0.0 109.766 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.404 ' HB1' ' NZ ' ' A' ' 75' ' ' LYS . . . -87.19 -33.5 19.34 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.396 -0.815 . . . . 0.0 109.421 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.636 ' NZ ' ' CZ ' ' A' ' 112' ' ' PHE . 0.7 OUTLIER -162.32 155.66 20.49 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.279 -0.888 . . . . 0.0 109.353 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -104.45 156.36 18.0 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.319 -0.863 . . . . 0.0 109.171 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.636 ' CZ ' ' NZ ' ' A' ' 110' ' ' LYS . 24.1 m-85 -139.67 157.39 45.85 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.207 -0.933 . . . . 0.0 109.895 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -119.99 109.22 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.559 -0.713 . . . . 0.0 109.305 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.469 HG23 ' HB3' ' A' ' 119' ' ' GLU . 35.3 mm -98.73 152.02 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.444 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.8 t -139.39 7.23 2.36 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.221 -0.924 . . . . 0.0 109.265 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.403 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.8 OUTLIER -142.0 155.26 45.43 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.194 -0.941 . . . . 0.0 109.511 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -70.21 -34.92 73.5 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.15 -0.969 . . . . 0.0 109.613 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.699 ' HE2' ' OE2' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -75.28 -16.29 60.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.155 -0.966 . . . . 0.0 109.103 179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.58 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 1.7 mp0 -86.4 -4.85 59.24 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.35 -0.844 . . . . 0.0 109.513 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.455 ' HG ' HG21 ' A' ' 114' ' ' ILE . 0.7 OUTLIER -99.65 8.74 44.12 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.255 -0.903 . . . . 0.0 108.965 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.699 ' OE2' ' HE2' ' A' ' 118' ' ' LYS . 63.7 mt-10 -63.68 139.05 58.73 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 0.0 109.505 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.744 ' OE1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -52.23 -50.62 61.64 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . 0.744 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.4 OUTLIER -59.05 -42.47 90.36 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.895 -1.128 . . . . 0.0 109.687 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.58 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 63.7 t80 -55.48 -44.73 76.78 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.009 0.909 . . . . 0.0 109.064 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -74.47 -25.23 19.21 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -67.49 -52.64 36.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.242 -0.911 . . . . 0.0 109.188 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -20.11 65.49 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.242 -0.911 . . . . 0.0 109.234 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -71.65 -42.54 67.41 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.307 -0.871 . . . . 0.0 109.271 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.496 HD21 ' HB2' ' A' ' 77' ' ' ALA . 3.7 mt -73.88 -51.64 15.55 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.266 -0.896 . . . . 0.0 109.042 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -49.63 -23.44 1.7 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.209 -0.932 . . . . 0.0 109.287 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.41 -59.17 3.17 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.238 -0.914 . . . . 0.0 109.376 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . 50.64 69.11 0.67 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.309 -0.87 . . . . 0.0 109.474 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.517 ' C ' ' H ' ' A' ' 135' ' ' ALA . . . -167.64 76.74 0.12 Allowed Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -61.91 3.74 0.64 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.568 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . 55.43 45.01 26.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.161 -1.2 . . . . 0.0 109.437 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.735 HD22 ' N ' ' A' ' 137' ' ' TYR . 0.4 OUTLIER -46.51 -12.54 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.259 -0.901 . . . . 0.0 109.472 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.735 ' N ' HD22 ' A' ' 136' ' ' ASN . 0.2 OUTLIER -58.26 -15.5 10.34 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.232 -0.917 . . . . 0.0 109.451 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -93.36 -48.61 6.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.326 -0.859 . . . . 0.0 109.472 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 47.32 85.64 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.226 -0.921 . . . . 0.0 109.475 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 -78.33 9.76 3.61 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.311 -0.868 . . . . 0.0 109.519 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.73 7.68 35.6 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.248 -0.907 . . . . 0.0 109.537 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 118.022 -0.99 . . . . 0.0 109.413 179.961 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mmm . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' A' ' 3' ' ' THR . . . -149.36 122.09 8.66 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.242 -0.911 . . . . 0.0 109.52 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.919 HG21 ' OD1' ' A' ' 97' ' ' ASP . 7.2 m 59.35 147.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.292 -0.88 . . . . 0.0 109.475 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HB2' HG23 ' A' ' 35' ' ' THR . 45.4 mttp -123.67 129.06 50.54 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 109.532 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.503 HG23 ' O ' ' A' ' 5' ' ' ILE . 2.8 tp -107.66 125.37 64.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.478 -0.764 . . . . 0.0 109.315 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.588 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.4 m-20 -97.61 43.39 1.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.208 -0.932 . . . . 0.0 109.293 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.438 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -42.32 -18.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 109.53 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' A' ' 6' ' ' ASP . 34.4 mt-10 -55.89 -49.41 73.5 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 108.981 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -61.64 -66.58 0.51 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.353 -0.842 . . . . 0.0 108.939 179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 1.6 m -44.83 -59.08 2.71 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.286 -0.884 . . . . 0.0 109.17 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.411 ' O ' ' C ' ' A' ' 12' ' ' ALA . 39.0 ttp180 -44.29 -56.06 4.45 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.034 -1.041 . . . . 0.0 109.744 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.411 ' C ' ' O ' ' A' ' 11' ' ' ARG . . . -42.74 -50.94 5.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.349 -0.845 . . . . 0.0 109.818 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.914 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -82.93 -35.07 26.35 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.377 -0.827 . . . . 0.0 110.262 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.704 ' CZ ' ' CE1' ' A' ' 61' ' ' PHE . 3.1 t80 -45.55 -65.79 0.49 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.367 -0.833 . . . . 0.0 110.302 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.69 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 3.5 m-80 -70.7 -44.55 66.71 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.326 -0.859 . . . . 0.0 110.756 -178.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.814 HD13 ' C ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -51.75 -40.82 60.94 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.928 -1.107 . . . . 0.0 109.396 -179.158 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.914 HG23 ' O ' ' A' ' 13' ' ' ALA . 98.3 t -51.31 -2.37 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 120.934 -1.103 . . . . 0.0 109.735 -179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.604 ' H ' ' C ' ' A' ' 16' ' ' LEU . 1.6 ttp180 -105.68 -0.61 25.39 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.114 -0.991 . . . . 0.0 109.127 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -84.71 153.5 23.04 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.245 -0.909 . . . . 0.0 109.724 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -64.03 -13.32 45.94 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.354 -0.841 . . . . 0.0 110.036 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.446 ' O ' ' OG ' ' A' ' 22' ' ' SER . . . -97.13 -80.96 1.56 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.678 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 99.0 p 52.99 -130.8 2.2 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.544 -0.974 . . . . 0.0 110.455 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.678 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 146.32 -45.76 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.819 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.704 ' O ' HG13 ' A' ' 24' ' ' VAL . 13.0 p -85.53 109.97 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.909 HG23 ' CD1' ' A' ' 26' ' ' TRP . 14.0 tt -56.86 -32.89 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.121 -0.987 . . . . 0.0 108.822 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.909 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.0 p-90 -160.7 149.67 16.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.229 -0.919 . . . . 0.0 109.876 178.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.553 HG11 ' CB ' ' A' ' 13' ' ' ALA . 15.1 m -117.55 134.73 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.487 -0.758 . . . . 0.0 109.263 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.575 HG23 ' CE3' ' A' ' 26' ' ' TRP . 40.8 p -124.9 143.63 50.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.362 -0.836 . . . . 0.0 109.901 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.654 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -121.74 163.6 18.81 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -140.89 146.67 37.77 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.359 -0.838 . . . . 0.0 109.835 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.609 ' OH ' HG23 ' A' ' 94' ' ' THR . 3.3 m-85 -58.99 98.71 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.417 -0.802 . . . . 0.0 110.092 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.488 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.1 OUTLIER -100.02 101.19 12.2 Favored 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 73.08 -122.18 7.96 Favored Glycine 0 N--CA 1.488 2.151 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.13 22.72 15.51 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.352 -1.087 . . . . 0.0 110.352 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.514 HG23 ' HB2' ' A' ' 4' ' ' LYS . 4.0 m -138.39 153.88 48.92 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.081 -1.012 . . . . 0.0 110.197 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.519 HG22 ' O ' ' A' ' 36' ' ' ILE . 1.7 mp -109.79 103.77 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.411 -0.806 . . . . 0.0 109.139 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 38' ' ' PRO . 1.2 m -135.83 154.95 78.21 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.164 -0.96 . . . . 0.0 109.771 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.407 ' HG3' ' HB1' ' A' ' 9' ' ' ALA . 88.1 Cg_exo -32.27 140.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.443 0 C-N-CA 123.231 2.621 . . . . 0.0 112.546 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -141.88 -21.51 0.25 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.551 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.18 -178.89 6.07 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.389 -1.065 . . . . 0.0 109.622 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.624 ' NE2' ' O ' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -157.74 179.81 8.86 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.627 0.727 . . . . 0.0 110.761 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.666 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -163.49 133.64 3.12 Favored Glycine 0 N--CA 1.485 1.951 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.456 ' O ' ' OD1' ' A' ' 44' ' ' ASP . . . -106.5 -8.56 17.01 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 106.718 -1.586 . . . . 0.0 106.718 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' A' ' 43' ' ' ALA . 59.5 m-20 -157.57 175.38 14.01 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.09 -41.37 67.39 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.806 -1.184 . . . . 0.0 109.267 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -51.58 -32.81 29.92 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.115 -0.991 . . . . 0.0 110.288 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.609 ' CE1' HE22 ' A' ' 41' ' ' GLN . 0.7 OUTLIER -65.37 -15.42 62.55 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 120.93 -1.106 . . . . 0.0 109.955 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.579 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -82.09 -27.65 32.78 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 120.941 -1.099 . . . . 0.0 108.774 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.445 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.9 mt -79.97 -19.36 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.251 -0.906 . . . . 0.0 110.91 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.546 ' NE2' ' C ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -87.02 -45.92 10.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.391 -1.443 . . . . 0.0 109.967 -179.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.601 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -105.32 56.66 0.68 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.261 -0.899 . . . . 0.0 110.884 -178.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 t -158.5 65.73 0.44 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.062 -1.023 . . . . 0.0 109.501 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 55' ' ' ASP . 20.6 p -85.19 150.62 24.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -0.924 . . . . 0.0 109.915 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.495 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 2.5 p30 -51.58 -4.05 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.453 -0.779 . . . . 0.0 109.99 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.553 ' OD1' ' HB3' ' A' ' 85' ' ' ASP . 1.1 t0 -94.64 20.71 8.19 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.03 -1.044 . . . . 0.0 109.307 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.608 HG23 ' NH2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -138.72 151.2 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.295 -0.878 . . . . 0.0 109.654 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.679 ' HG2' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -130.98 131.54 44.45 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.485 -0.76 . . . . 0.0 109.801 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.759 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.66 175.52 3.43 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.995 -1.066 . . . . 0.0 110.504 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.568 ' O ' HG22 ' A' ' 28' ' ' THR . 1.0 OUTLIER -111.24 152.68 26.87 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.501 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -132.57 156.99 45.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.956 -1.09 . . . . 0.0 109.628 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.704 ' CE1' ' CZ ' ' A' ' 14' ' ' TYR . 64.5 t80 -149.46 97.02 2.58 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.217 -0.927 . . . . 0.0 109.361 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.01 156.53 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.307 -0.871 . . . . 0.0 109.467 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.0 ttp180 -79.66 113.06 17.52 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.427 -0.796 . . . . 0.0 109.01 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -92.59 154.65 18.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.256 -0.902 . . . . 0.0 109.72 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.2 t -78.26 163.4 25.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 108.975 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.9 -36.76 0.18 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.258 -0.901 . . . . 0.0 109.518 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -86.42 -97.05 0.81 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.667 ' O ' ' HB3' ' A' ' 69' ' ' ALA . 5.3 p-10 -137.19 42.96 2.37 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.236 -1.155 . . . . 0.0 109.541 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 68' ' ' ASP . . . 73.61 -26.85 0.19 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.24 -0.913 . . . . 0.0 109.483 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.496 ' H ' ' C ' ' A' ' 68' ' ' ASP . 0.4 OUTLIER -61.75 132.51 53.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.273 -0.892 . . . . 0.0 109.431 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.2 p -68.9 83.47 0.31 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.212 -0.93 . . . . 0.0 109.44 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -136.22 0.86 2.62 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.202 -0.936 . . . . 0.0 109.485 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -173.91 -68.09 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.238 -0.914 . . . . 0.0 109.484 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 62.26 149.6 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.199 -0.938 . . . . 0.0 109.416 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.451 ' HG3' ' HB2' ' A' ' 109' ' ' ALA . 6.9 ttmt -107.91 165.34 11.53 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.327 -0.858 . . . . 0.0 109.313 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.69 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 2.0 m-85 -133.25 128.65 36.32 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.188 -0.945 . . . . 0.0 109.813 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.78 167.06 23.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.341 -0.849 . . . . 0.0 110.581 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tt -117.41 157.65 25.84 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.492 HD11 HD12 ' A' ' 125' ' ' ILE . 3.1 mt -135.16 148.27 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.03 -1.044 . . . . 0.0 109.248 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.44 HG22 HD11 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -108.06 113.95 27.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.356 -0.84 . . . . 0.0 109.827 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.426 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 66.6 t-105 -94.66 111.17 22.94 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.018 -1.051 . . . . 0.0 109.604 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.44 HD11 HG22 ' A' ' 80' ' ' THR . 20.8 mm -112.24 92.99 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -53.29 149.29 12.97 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -94.35 35.24 1.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.32 -1.106 . . . . 0.0 109.554 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.553 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -153.29 25.97 0.53 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.679 HG21 ' HG2' ' A' ' 57' ' ' ARG . 4.0 p -98.11 159.63 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.15 -0.968 . . . . 0.0 109.725 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.4 p -71.9 -176.24 1.64 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.271 -0.893 . . . . 0.0 110.01 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.19 -18.19 63.28 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -46.4 -57.2 4.87 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.083 -1.245 . . . . 0.0 109.618 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 49.0 mm-40 -57.51 -30.97 65.57 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.208 -0.933 . . . . 0.0 109.23 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 6.6 tpt180 -45.33 -56.42 4.94 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.053 -1.03 . . . . 0.0 109.425 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.82 -35.2 38.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.215 -0.928 . . . . 0.0 109.823 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 10.2 mttt -69.66 -61.64 1.7 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.128 -0.982 . . . . 0.0 109.875 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.609 HG23 ' OH ' ' A' ' 31' ' ' TYR . 28.4 m -45.02 -49.83 11.11 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.289 -0.882 . . . . 0.0 109.65 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -51.66 -59.43 8.55 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 74.1 p -65.01 -48.29 74.44 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.014 -1.286 . . . . 0.0 111.173 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.919 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.0 OUTLIER -69.08 -41.1 77.97 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.82 -1.175 . . . . 0.0 111.617 -177.535 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.404 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -61.23 -22.18 64.55 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 120.768 -1.208 . . . . 0.0 109.459 -179.416 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 20.4 m -73.92 -44.85 53.78 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.227 -0.92 . . . . 0.0 109.426 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.455 ' N ' HD12 ' A' ' 100' ' ' LEU . 8.1 mp -59.13 -54.73 43.63 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.204 -0.935 . . . . 0.0 109.586 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -28.05 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.164 -0.96 . . . . 0.0 109.914 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -70.72 -37.93 73.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.14 -0.975 . . . . 0.0 109.784 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.79 -22.39 60.84 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.158 -0.964 . . . . 0.0 109.732 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.797 HG12 ' O ' ' A' ' 104' ' ' VAL . 88.6 t -94.26 33.82 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 121.231 -0.918 . . . . 0.0 109.55 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 105' ' ' VAL . 12.1 t -131.75 98.93 3.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.298 -0.876 . . . . 0.0 109.873 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.595 ' O ' ' N ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -119.1 -41.4 2.75 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.394 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.69 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 33.2 p-10 -63.9 41.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 119.936 -0.705 . . . . 0.0 110.073 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.595 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -142.4 174.69 10.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.345 -0.847 . . . . 0.0 109.601 179.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.451 ' HB2' ' HG3' ' A' ' 75' ' ' LYS . . . -88.07 -56.76 3.19 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.205 -0.934 . . . . 0.0 109.5 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.514 ' CG ' ' N ' ' A' ' 111' ' ' GLU . 9.3 ttpp -162.37 167.17 24.15 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.294 -0.878 . . . . 0.0 109.33 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.514 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.2 OUTLIER -104.37 154.06 20.3 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.192 -0.943 . . . . 0.0 108.968 179.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -128.61 156.2 43.74 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.444 -0.785 . . . . 0.0 110.166 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.569 ' O ' HD13 ' A' ' 114' ' ' ILE . 33.4 t -115.16 143.11 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.711 HG21 ' CD2' ' A' ' 120' ' ' LEU . 18.8 mm -136.08 154.07 32.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.078 -1.013 . . . . 0.0 110.439 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 64.4 m -140.59 3.6 1.9 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.611 -0.681 . . . . 0.0 109.218 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 1.164 ' OD1' ' CD ' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -143.12 155.29 44.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.189 -0.945 . . . . 0.0 109.526 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -73.96 -33.25 63.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 109.824 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.61 -8.76 54.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.199 -0.938 . . . . 0.0 109.007 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 1.164 ' CD ' ' OD1' ' A' ' 116' ' ' ASP . 21.7 mt-10 -86.35 -0.48 56.0 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.711 ' CD2' HG21 ' A' ' 114' ' ' ILE . 2.6 mm? -94.71 1.29 55.49 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.214 -0.929 . . . . 0.0 108.814 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.45 145.77 54.96 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.538 -0.726 . . . . 0.0 109.701 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -62.33 -49.24 76.41 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.947 . . . . 0.0 109.581 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -55.15 -21.94 15.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.324 -0.86 . . . . 0.0 109.852 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.455 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 67.5 t80 -83.31 -49.21 9.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.301 -0.874 . . . . 0.0 109.148 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.492 HD12 HD11 ' A' ' 79' ' ' ILE . 4.5 mm -71.94 -25.2 23.61 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -65.09 -52.39 55.83 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.198 -0.939 . . . . 0.0 108.729 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.3 t -58.74 -24.5 61.71 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.323 -0.861 . . . . 0.0 109.197 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -72.84 -40.65 65.57 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.295 -0.878 . . . . 0.0 109.268 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.435 HD22 ' CD ' ' A' ' 75' ' ' LYS . 19.2 mt -73.64 -53.11 11.21 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.219 -0.925 . . . . 0.0 109.131 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 130' ' ' LYS . 11.3 mptt -60.35 -7.25 1.9 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.143 -0.973 . . . . 0.0 109.601 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.27 -60.21 2.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.908 . . . . 0.0 109.402 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -138.09 102.68 4.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.266 -0.896 . . . . 0.0 109.445 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -163.06 46.55 0.33 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.538 ' O ' ' N ' ' A' ' 136' ' ' ASN . . . -156.57 -74.86 0.02 OUTLIER Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.89 72.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.272 -1.134 . . . . 0.0 109.494 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.538 ' N ' ' O ' ' A' ' 134' ' ' GLY . 5.3 t-20 -104.08 67.41 0.86 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.291 -0.881 . . . . 0.0 109.535 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.515 ' CD1' ' O ' ' A' ' 137' ' ' TYR . 0.4 OUTLIER -98.7 -36.96 9.68 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.273 -0.892 . . . . 0.0 109.466 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 140' ' ' GLN . 0.0 OUTLIER -42.99 -34.94 1.08 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.287 -0.883 . . . . 0.0 109.535 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . 52.1 7.66 0.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.234 -0.916 . . . . 0.0 109.475 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 138' ' ' ASP . 1.0 OUTLIER -91.23 110.49 21.77 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.29 -0.881 . . . . 0.0 109.495 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.32 112.29 23.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.226 -0.922 . . . . 0.0 109.45 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.451 179.936 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.2 mtt . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.436 ' C ' ' OG1' ' A' ' 3' ' ' THR . . . -96.8 130.75 44.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.283 -0.886 . . . . 0.0 109.505 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.436 ' OG1' ' C ' ' A' ' 2' ' ' ALA . 0.1 OUTLIER 63.03 138.04 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.291 -0.881 . . . . 0.0 109.402 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -137.32 118.21 14.22 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.275 -0.891 . . . . 0.0 109.364 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.437 HG23 ' HG3' ' A' ' 7' ' ' LYS . 2.0 tt -110.79 142.72 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.404 -0.81 . . . . 0.0 109.615 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.57 ' O ' ' N ' ' A' ' 8' ' ' GLU . 4.5 m-20 -93.4 40.84 1.07 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.189 -0.944 . . . . 0.0 109.154 179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.482 ' HB3' HG11 ' A' ' 104' ' ' VAL . 0.0 OUTLIER -40.17 -22.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.394 -0.816 . . . . 0.0 109.712 -179.495 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.57 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.3 tt0 -50.32 -34.05 22.36 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.186 -0.946 . . . . 0.0 109.232 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.8 -60.25 2.37 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.357 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.89 -62.82 1.08 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.209 -0.932 . . . . 0.0 109.682 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.654 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 38.7 ttp180 -45.17 -53.66 7.86 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.951 -1.093 . . . . 0.0 109.221 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.93 -58.29 8.49 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.339 -0.85 . . . . 0.0 109.757 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.543 ' HB3' HG11 ' A' ' 27' ' ' VAL . . . -58.55 -25.57 62.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.116 -0.99 . . . . 0.0 109.675 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.535 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -70.76 -48.31 55.02 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.368 -0.832 . . . . 0.0 109.492 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.735 ' ND2' HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -79.58 -11.06 59.89 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.272 -0.893 . . . . 0.0 109.555 -179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.416 ' HA ' HD12 ' A' ' 16' ' ' LEU . 6.6 tp -76.76 -29.01 55.93 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.265 -0.897 . . . . 0.0 109.212 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.696 HG12 HG13 ' A' ' 24' ' ' VAL . 0.8 OUTLIER -72.1 -1.57 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.298 -0.876 . . . . 0.0 109.194 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.512 ' CG ' ' O ' ' A' ' 18' ' ' ARG . 22.1 ttp180 -118.76 -1.03 11.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.535 -0.728 . . . . 0.0 109.188 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.595 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.3 OUTLIER -94.58 26.86 3.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.206 -0.934 . . . . 0.0 109.969 -179.57 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.532 ' C ' ' O ' ' A' ' 19' ' ' ASP . 4.9 m-20 29.55 35.53 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.766 -0.584 . . . . 0.0 110.406 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.595 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . -121.36 -76.1 0.41 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.596 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 37.1 t -67.97 -30.72 70.06 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.212 -1.169 . . . . 0.0 110.089 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 22' ' ' SER . . . 68.52 4.94 4.54 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.093 -1.004 . . . . 0.0 109.659 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.696 HG13 HG12 ' A' ' 17' ' ' VAL . 2.5 p -58.41 78.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.131 -0.98 . . . . 0.0 108.94 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.592 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -41.02 -59.04 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 O-C-N 121.409 -0.807 . . . . 0.0 109.949 -179.214 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.66 ' CE3' HG23 ' A' ' 28' ' ' THR . 27.0 p-90 -134.02 156.49 48.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.826 -1.171 . . . . 0.0 110.834 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.543 HG11 ' HB3' ' A' ' 13' ' ' ALA . 1.5 p -134.27 135.77 53.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.66 HG23 ' CE3' ' A' ' 26' ' ' TRP . 70.7 p -124.28 146.22 48.91 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.097 -1.002 . . . . 0.0 110.541 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.92 136.9 54.19 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 32' ' ' ASP . 26.9 ptt180 -113.47 146.1 40.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.487 -0.758 . . . . 0.0 109.982 -178.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.681 ' CD2' ' NE2' ' A' ' 90' ' ' GLN . 1.9 m-85 -41.21 98.63 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.565 -0.709 . . . . 0.0 109.781 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.3 OUTLIER -97.1 101.76 13.4 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 178.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 55.83 -119.35 13.74 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.166 -1.574 . . . . 0.0 109.166 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.83 22.46 15.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.453 -1.028 . . . . 0.0 110.098 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 43.8 m -145.31 134.06 22.29 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.123 -0.986 . . . . 0.0 109.909 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.3 mp -78.98 113.45 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.284 -0.885 . . . . 0.0 108.997 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.41 150.5 72.59 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.286 -0.884 . . . . 0.0 109.871 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -35.53 146.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.412 0 C-N-CA 122.895 2.397 . . . . 0.0 112.303 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -136.99 -38.64 0.15 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.577 ' CG ' HE22 ' A' ' 51' ' ' GLN . 3.5 m-20 -142.62 -179.38 6.27 Favored 'General case' 0 C--N 1.296 -1.761 0 O-C-N 121.714 -0.874 . . . . 0.0 109.285 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.848 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -158.12 -169.39 2.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.354 -0.841 . . . . 0.0 109.685 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.15 143.96 7.75 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 119.521 -1.323 . . . . 0.0 110.163 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.04 0.29 29.65 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.463 ' C ' HD13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -152.29 170.71 19.37 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.425 ' O ' ' C ' ' A' ' 46' ' ' GLN . 17.8 p90 -79.63 -39.72 30.89 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.625 -1.297 . . . . 0.0 109.03 179.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.425 ' C ' ' O ' ' A' ' 45' ' ' TYR . 6.0 mm-40 -42.42 -33.84 0.73 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.078 -1.014 . . . . 0.0 109.994 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.518 ' NE2' ' OE1' ' A' ' 50' ' ' GLN . 2.1 t-160 -61.74 -41.75 98.06 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 120.82 -1.175 . . . . 0.0 109.108 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.648 ' CE1' HD13 ' A' ' 120' ' ' LEU . 0.1 OUTLIER -47.67 -33.22 6.56 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.128 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.404 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mt -64.63 -42.11 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.158 -0.964 . . . . 0.0 109.111 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.574 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 5.3 tm0? -86.96 -12.62 47.0 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.577 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.5 mm100 -109.97 67.25 0.64 Allowed 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.313 1.054 . . . . 0.0 110.472 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.694 ' SG ' HD11 ' A' ' 58' ' ' LEU . 1.2 m 158.61 59.19 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.009 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.524 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.4 p -77.41 164.02 25.86 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.966 -1.084 . . . . 0.0 109.707 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.547 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.3 OUTLIER -65.46 -4.52 5.88 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.0 109.632 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -102.29 14.46 31.89 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.282 -0.886 . . . . 0.0 109.504 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 53' ' ' THR . 2.5 p -138.18 157.14 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.236 -0.915 . . . . 0.0 109.745 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.522 ' N ' ' CD ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -134.76 129.03 34.0 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.478 -0.764 . . . . 0.0 109.554 179.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.752 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.7 pp -172.49 172.73 4.25 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.09 -1.006 . . . . 0.0 110.294 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.515 ' O ' HG22 ' A' ' 28' ' ' THR . 2.7 m-85 -104.34 153.55 20.92 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.117 -0.99 . . . . 0.0 108.846 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.427 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.05 156.93 46.48 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.02 -1.05 . . . . 0.0 109.633 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.404 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 47.7 t80 -148.91 96.54 2.57 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -113.5 159.27 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.31 -0.868 . . . . 0.0 109.609 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.583 ' NE ' ' OG ' ' A' ' 74' ' ' SER . 1.1 ttt-85 -84.7 140.65 31.14 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.299 -0.875 . . . . 0.0 108.735 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -123.62 156.05 36.55 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.807 . . . . 0.0 110.221 -179.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.6 t -77.22 135.11 38.46 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.1 m -109.61 37.79 2.53 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.476 -0.765 . . . . 0.0 109.5 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.588 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 173.01 108.98 0.22 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.486 ' OD1' ' NH1' ' A' ' 126' ' ' ARG . 1.0 OUTLIER -43.12 91.72 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.225 -1.162 . . . . 0.0 109.506 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.588 ' N ' ' O ' ' A' ' 67' ' ' GLY . . . 55.09 43.04 30.24 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.319 -0.863 . . . . 0.0 109.438 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 19.6 ttt -146.64 156.95 43.59 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.331 -0.856 . . . . 0.0 109.482 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 63.57 148.53 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.211 -0.93 . . . . 0.0 109.488 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -99.14 -24.84 14.73 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.9 mtm180 -58.11 174.93 0.24 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 0.0 109.432 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.583 ' OG ' ' NE ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -138.39 171.28 14.61 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.295 -0.878 . . . . 0.0 109.444 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -105.93 155.38 19.41 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.357 -0.84 . . . . 0.0 109.311 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.442 ' O ' ' N ' ' A' ' 109' ' ' ALA . 93.8 m-85 -134.02 120.25 20.01 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.394 -0.816 . . . . 0.0 109.746 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.74 167.2 22.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.127 -0.983 . . . . 0.0 110.604 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tt -121.18 155.42 34.59 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.483 HD11 ' CD1' ' A' ' 125' ' ' ILE . 3.2 mm -134.7 143.06 38.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.168 -0.957 . . . . 0.0 109.046 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.42 HG23 ' CD2' ' A' ' 59' ' ' PHE . 2.7 m -104.14 117.06 33.36 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 109.674 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.5 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -92.97 111.49 23.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.048 -1.033 . . . . 0.0 109.69 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -110.11 93.12 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.323 -0.861 . . . . 0.0 108.746 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -52.07 158.7 3.0 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -96.95 19.88 12.04 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.295 -1.121 . . . . 0.0 109.734 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -132.16 26.81 4.53 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.865 . . . . 0.0 109.215 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.485 HG22 ' HD2' ' A' ' 57' ' ' ARG . 4.1 t -91.21 160.98 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.357 -0.839 . . . . 0.0 110.094 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.1 t -93.37 -161.32 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.379 -0.825 . . . . 0.0 108.985 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -20.62 59.19 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.969 -1.253 . . . . 0.0 109.969 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.59 -64.65 0.71 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.987 -1.302 . . . . 0.0 110.023 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.681 ' NE2' ' CD2' ' A' ' 31' ' ' TYR . 10.8 mm100 -56.75 -30.22 63.37 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 9.8 tmm_? -49.6 -59.51 3.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.798 -1.188 . . . . 0.0 109.633 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.38 -39.88 27.58 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.174 -0.954 . . . . 0.0 109.796 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.447 ' C ' ' OH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -60.27 -65.3 0.71 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 109.515 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 51.1 m -45.16 -43.11 9.7 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.0 109.572 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.07 -60.45 3.5 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.8 m -66.05 -47.95 72.65 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.118 -1.225 . . . . 0.0 111.075 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' C ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -68.77 -42.86 76.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.78 -1.2 . . . . 0.0 111.386 -177.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -25.12 53.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.595 -1.316 . . . . 0.0 108.745 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 96.1 m -81.33 -20.7 40.14 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 100' ' ' LEU . 53.2 mt -78.98 -63.79 1.33 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.44 -0.787 . . . . 0.0 109.185 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -50.3 -33.11 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.214 -0.929 . . . . 0.0 109.975 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.985 ' HE2' ' HG2' ' A' ' 111' ' ' GLU . 1.4 tttm -75.07 -42.37 57.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.269 -0.894 . . . . 0.0 109.751 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.31 -39.33 85.88 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.168 -0.957 . . . . 0.0 110.203 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.482 HG11 ' HB3' ' A' ' 7' ' ' LYS . 12.8 p -78.16 -25.68 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.07 -1.018 . . . . 0.0 109.926 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 102' ' ' LYS . 1.0 OUTLIER -42.8 138.4 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.105 -0.997 . . . . 0.0 109.518 -179.927 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.47 ' NE2' ' CD ' ' A' ' 11' ' ' ARG . 11.6 pt20 -144.29 20.07 1.73 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.072 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.735 HD22 ' ND2' ' A' ' 15' ' ' ASN . 1.4 t-20 -143.18 41.16 1.5 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.896 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.566 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -142.52 158.0 44.14 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.048 -1.032 . . . . 0.0 109.867 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -93.6 -34.34 13.35 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.354 -0.842 . . . . 0.0 109.446 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -162.27 159.54 25.74 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.871 . . . . 0.0 109.314 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.985 ' HG2' ' HE2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -104.2 150.69 24.15 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.199 -0.938 . . . . 0.0 109.337 -179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 79' ' ' ILE . 62.0 m-85 -133.84 157.62 45.46 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.451 -0.78 . . . . 0.0 109.701 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.6 t -121.19 142.47 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.455 HD12 ' OE1' ' A' ' 119' ' ' GLU . 1.8 mm -137.26 156.59 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.262 -0.899 . . . . 0.0 110.058 -179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.482 ' O ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -140.64 9.19 2.2 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.313 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.607 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -158.79 157.05 30.88 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -179.825 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -79.74 -18.96 49.88 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.918 -1.114 . . . . 0.0 110.209 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -62.8 -50.06 72.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.087 -1.008 . . . . 0.0 110.428 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.607 ' OE2' ' N ' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -80.79 4.74 18.07 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.104 -0.997 . . . . 0.0 110.279 -179.098 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.648 HD13 ' CE1' ' A' ' 48' ' ' PHE . 0.7 OUTLIER -96.38 16.62 17.99 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.007 -1.058 . . . . 0.0 108.405 179.509 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -74.63 154.6 38.45 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.66 -0.65 . . . . 0.0 109.78 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -55.41 -48.22 74.72 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.424 -0.798 . . . . 0.0 109.49 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . 0.551 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 1.3 p30 -56.97 -41.59 78.62 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.23 -0.919 . . . . 0.0 109.658 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CG ' ' O ' ' A' ' 119' ' ' GLU . 15.4 t80 -60.36 -48.0 83.62 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.094 0.95 . . . . 0.0 109.093 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.483 ' CD1' HD11 ' A' ' 79' ' ' ILE . 1.4 mm -71.22 -40.15 74.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.486 ' NH1' ' OD1' ' A' ' 68' ' ' ASP . 33.5 ttp180 -62.14 -53.37 56.39 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.203 -0.935 . . . . 0.0 109.039 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.31 -15.06 13.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.384 -0.822 . . . . 0.0 109.49 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.422 ' OE2' ' CZ ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -83.52 -37.24 23.32 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.21 -0.931 . . . . 0.0 109.358 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.593 ' C ' ' H ' ' A' ' 131' ' ' LYS . 46.8 mt -69.08 -39.72 78.88 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.193 -0.942 . . . . 0.0 108.631 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.908 ' HZ2' ' HB2' ' A' ' 132' ' ' ALA . 0.2 OUTLIER -53.23 -5.43 0.05 OUTLIER 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.137 -0.977 . . . . 0.0 108.645 179.135 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.593 ' H ' ' C ' ' A' ' 129' ' ' LEU . 11.2 tttt 60.93 102.56 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.71 0.767 . . . . 0.0 109.477 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.908 ' HB2' ' HZ2' ' A' ' 130' ' ' LYS . . . -141.54 -33.88 0.49 Allowed 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.551 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -95.92 138.72 14.1 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . 153.78 170.01 19.35 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 69.78 43.07 0.99 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.215 -1.168 . . . . 0.0 109.459 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' A' ' 135' ' ' ALA . 8.3 p30 43.29 18.1 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.171 -0.956 . . . . 0.0 109.401 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.585 ' N ' ' O ' ' A' ' 135' ' ' ALA . 10.6 t80 -75.71 5.28 6.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.282 -0.886 . . . . 0.0 109.471 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.486 ' C ' ' H ' ' A' ' 140' ' ' GLN . 66.5 m-20 -90.66 -72.07 0.59 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.259 -0.901 . . . . 0.0 109.456 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.21 4.86 0.43 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.304 -0.873 . . . . 0.0 109.437 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.486 ' H ' ' C ' ' A' ' 138' ' ' ASP . 17.4 mt-30 53.62 -175.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 109.41 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 5.4 p -83.1 -171.34 3.51 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.287 -0.883 . . . . 0.0 109.444 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 118.08 -0.962 . . . . 0.0 109.498 -179.993 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.683 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 15.5 ttt . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.683 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 74.47 -60.26 0.53 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.312 -0.867 . . . . 0.0 109.466 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.671 HG21 ' OD1' ' A' ' 97' ' ' ASP . 2.4 m -90.3 151.27 21.56 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.299 -0.876 . . . . 0.0 109.395 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.581 ' HB3' HG23 ' A' ' 35' ' ' THR . 0.1 OUTLIER -138.26 125.1 21.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.185 -0.947 . . . . 0.0 109.44 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.3 137.25 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.391 -0.818 . . . . 0.0 109.694 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.558 ' O ' ' N ' ' A' ' 8' ' ' GLU . 6.3 t70 -64.04 -44.61 91.98 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.276 -0.89 . . . . 0.0 109.381 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.682 ' HD3' HG21 ' A' ' 104' ' ' VAL . 1.5 mtmt 63.89 -50.21 0.26 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.445 -0.785 . . . . 0.0 110.184 179.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 6' ' ' ASP . 10.9 mt-10 -51.8 -49.29 63.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.111 -0.993 . . . . 0.0 109.809 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.69 -69.02 0.27 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 109.999 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.613 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 4.1 m -46.08 -65.34 0.56 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.22 -0.925 . . . . 0.0 110.125 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.519 ' HG3' HH11 ' A' ' 11' ' ' ARG . 0.9 OUTLIER -44.78 -58.39 3.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.985 -1.072 . . . . 0.0 110.144 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.95 -45.28 78.88 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.131 -0.981 . . . . 0.0 110.049 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.425 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -75.88 -17.02 59.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.058 -1.026 . . . . 0.0 110.183 -179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-30 -74.27 -52.96 10.76 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.125 -0.984 . . . . 0.0 109.539 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.671 ' ND2' ' ND2' ' A' ' 107' ' ' ASN . 1.8 m-80 -71.93 -13.32 61.61 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 109.42 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.543 HD23 HG22 ' A' ' 24' ' ' VAL . 4.8 tp -70.87 -47.99 56.23 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.356 -0.84 . . . . 0.0 109.575 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 14' ' ' TYR . 18.7 m -64.97 -14.0 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.218 -0.926 . . . . 0.0 109.563 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.573 ' NH2' ' OD1' ' A' ' 15' ' ' ASN . 20.1 ttm180 -71.83 -26.58 62.44 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.267 -0.896 . . . . 0.0 109.508 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.481 ' O ' ' O ' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -59.84 -144.76 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.226 -0.921 . . . . 0.0 109.449 -179.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -111.62 51.95 0.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.445 -0.785 . . . . 0.0 109.302 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 79.85 64.16 1.91 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.9 t -85.14 -49.09 8.53 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.316 -1.108 . . . . 0.0 109.605 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.543 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . -178.89 -157.9 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.198 -0.938 . . . . 0.0 109.71 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.806 HG23 ' O ' ' A' ' 24' ' ' VAL . 9.1 m 21.5 69.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-O 120.821 0.343 . . . . 0.0 111.378 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.796 HG23 ' CD1' ' A' ' 26' ' ' TRP . 13.0 tt -46.77 -31.06 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 120.743 -1.223 . . . . 0.0 108.08 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.796 ' CD1' HG23 ' A' ' 25' ' ' ILE . 22.8 p-90 -157.16 147.63 21.22 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.295 -0.878 . . . . 0.0 109.372 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.425 HG21 ' HB3' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -112.84 135.09 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.334 -0.854 . . . . 0.0 110.091 -179.381 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.624 HG22 ' O ' ' A' ' 59' ' ' PHE . 47.5 p -131.18 133.88 45.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.48 -0.762 . . . . 0.0 109.73 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.613 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -123.44 167.28 14.06 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -140.89 143.75 34.84 Favored 'General case' 0 C--N 1.295 -1.774 0 C-N-CA 119.231 -0.987 . . . . 0.0 109.813 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.638 ' OH ' HG23 ' A' ' 94' ' ' THR . 5.6 m-85 -50.37 98.68 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.544 -0.723 . . . . 0.0 109.744 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.66 101.35 13.04 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 69.08 -122.71 13.39 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.89 22.31 16.09 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.46 -1.023 . . . . 0.0 110.227 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.581 HG23 ' HB3' ' A' ' 4' ' ' LYS . 35.4 m -146.6 136.0 22.86 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.066 -1.021 . . . . 0.0 109.694 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.0 mp -77.56 115.8 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.108 -0.995 . . . . 0.0 108.768 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -135.31 154.13 78.47 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.244 -0.91 . . . . 0.0 109.822 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -39.67 141.59 0.55 Allowed 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.752 2.301 . . . . 0.0 112.388 179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.28 -40.8 0.17 Allowed Glycine 0 N--CA 1.489 2.216 0 N-CA-C 108.986 -1.646 . . . . 0.0 108.986 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.568 ' CG ' ' H ' ' A' ' 41' ' ' GLN . 14.8 t70 -144.19 179.65 7.09 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 121.75 -0.853 . . . . 0.0 108.83 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.89 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -140.81 177.11 8.26 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.406 -0.808 . . . . 0.0 110.546 -179.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.611 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -112.19 85.14 0.38 Allowed Glycine 0 N--CA 1.485 1.939 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.592 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -113.77 43.74 1.75 Allowed 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER 143.41 125.55 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -179.911 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -54.65 -53.86 49.23 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.819 -1.176 . . . . 0.0 109.551 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.462 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 5.1 mp0 -48.54 -20.22 0.41 Allowed 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.2 -0.938 . . . . 0.0 109.79 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.584 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -71.77 -34.01 69.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.195 -0.94 . . . . 0.0 109.225 179.655 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.592 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -56.03 -40.12 73.0 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.433 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.475 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.3 mt -58.74 -55.08 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.902 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.582 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -73.27 7.15 2.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.013 -1.055 . . . . 0.0 108.361 -179.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.585 ' O ' HG23 ' A' ' 53' ' ' THR . 9.1 mm100 -116.07 -75.73 0.58 Allowed 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.17 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.552 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 2.5 m -65.82 48.78 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.125 -0.984 . . . . 0.0 109.496 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 51' ' ' GLN . 0.7 OUTLIER -73.75 172.5 11.37 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.181 -0.949 . . . . 0.0 109.739 -179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.58 ' OD1' ' N ' ' A' ' 55' ' ' ASP . 1.1 p30 -55.27 -48.27 74.27 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.273 -0.892 . . . . 0.0 109.763 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.58 ' N ' ' OD1' ' A' ' 54' ' ' ASP . 0.5 OUTLIER -76.28 42.21 0.26 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 -179.874 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.561 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 96.0 t -148.19 147.18 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.176 -0.953 . . . . 0.0 109.836 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -138.38 120.91 16.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.404 -0.81 . . . . 0.0 109.516 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.748 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.5 pp -172.86 175.97 3.2 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.076 -1.015 . . . . 0.0 110.462 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.624 ' O ' HG22 ' A' ' 28' ' ' THR . 3.9 m-85 -104.46 152.03 22.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.984 -1.072 . . . . 0.0 108.807 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.441 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.43 152.04 51.87 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.965 -1.085 . . . . 0.0 109.017 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.461 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 39.5 t80 -150.82 96.93 2.41 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.978 -1.076 . . . . 0.0 109.498 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.55 154.89 14.87 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.248 -0.907 . . . . 0.0 108.949 179.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -80.7 113.29 18.79 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.359 -0.838 . . . . 0.0 108.983 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.546 ' CE2' ' HB3' ' A' ' 77' ' ' ALA . 12.5 m-85 -93.87 155.8 16.99 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.293 -0.88 . . . . 0.0 109.661 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.97 149.62 34.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.164 -0.96 . . . . 0.0 108.97 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.547 HG22 ' H ' ' A' ' 68' ' ' ASP . 90.5 m -109.96 -78.07 0.59 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.438 -0.789 . . . . 0.0 109.473 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 92.49 -31.06 6.32 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.547 ' H ' HG22 ' A' ' 66' ' ' THR . 0.5 OUTLIER -55.4 -62.61 1.56 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.257 -1.143 . . . . 0.0 109.494 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -45.03 153.7 0.18 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.208 -0.932 . . . . 0.0 109.521 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 29.7 ttm -47.3 -42.82 21.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.252 -0.905 . . . . 0.0 109.42 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.91 -139.28 0.33 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.454 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.524 ' O ' ' CB ' ' A' ' 73' ' ' ARG . 16.4 mttt -99.77 -77.14 0.53 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.197 -0.939 . . . . 0.0 109.557 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.524 ' CB ' ' O ' ' A' ' 72' ' ' LYS . 12.2 ttp180 77.04 -44.0 0.45 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.255 -0.903 . . . . 0.0 109.444 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.484 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 0.4 OUTLIER 73.49 153.06 0.13 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.313 -0.867 . . . . 0.0 109.487 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.616 ' HG2' HD22 ' A' ' 129' ' ' LEU . 0.6 OUTLIER -104.74 157.69 17.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.393 -0.817 . . . . 0.0 109.89 -179.606 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -133.26 119.73 20.18 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.458 -0.776 . . . . 0.0 109.054 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.698 ' HB2' HD21 ' A' ' 129' ' ' LEU . . . -144.09 156.8 44.5 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.091 -1.006 . . . . 0.0 110.947 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.6 tt -106.57 157.29 17.79 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.55 HG23 HD11 ' A' ' 114' ' ' ILE . 36.9 mt -137.36 133.26 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 120.92 -1.113 . . . . 0.0 109.066 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.44 HG23 ' CD2' ' A' ' 59' ' ' PHE . 1.3 m -95.72 117.76 31.12 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.165 -0.959 . . . . 0.0 109.653 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.561 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 64.1 t-105 -93.02 110.38 21.85 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.089 -1.007 . . . . 0.0 109.729 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -105.21 93.01 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -58.09 156.35 19.76 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.524 ' O ' ' N ' ' A' ' 86' ' ' VAL . 2.9 mm-40 -78.72 -51.47 9.76 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.223 -1.163 . . . . 0.0 109.63 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -67.0 39.36 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.183 -0.948 . . . . 0.0 109.57 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.524 ' N ' ' O ' ' A' ' 84' ' ' GLU . 92.8 t -96.63 157.3 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.23 -0.919 . . . . 0.0 109.725 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.434 ' N ' HG12 ' A' ' 86' ' ' VAL . 9.2 p -99.38 -161.49 0.88 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.324 -0.86 . . . . 0.0 109.461 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.03 -15.97 68.54 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.796 -1.322 . . . . 0.0 109.796 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.8 mp -46.93 -54.27 10.44 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.073 -1.251 . . . . 0.0 109.408 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.685 ' NE2' ' N ' ' A' ' 91' ' ' ARG . 0.0 OUTLIER -57.29 -35.16 69.46 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.865 . . . . 0.0 109.165 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.685 ' N ' ' NE2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -47.6 -62.72 1.31 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.061 -1.024 . . . . 0.0 109.961 -179.358 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -83.09 -40.52 19.72 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.13 -0.981 . . . . 0.0 110.132 -179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.444 ' O ' ' CG ' ' A' ' 97' ' ' ASP . 56.8 mmtt -61.66 -59.05 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.08 -1.013 . . . . 0.0 110.312 -179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.638 HG23 ' OH ' ' A' ' 31' ' ' TYR . 27.3 m -55.78 -49.09 74.1 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.962 -1.086 . . . . 0.0 109.516 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.47 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.87 -62.12 2.75 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.7 p -64.91 -49.26 71.11 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.118 -1.225 . . . . 0.0 111.104 -178.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.671 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.3 OUTLIER -66.85 -42.18 86.13 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.914 -1.116 . . . . 0.0 111.401 -177.824 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -22.64 63.55 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.623 -1.298 . . . . 0.0 109.201 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -82.3 -21.47 36.11 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.368 -0.833 . . . . 0.0 108.812 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.4 mt -83.46 -61.94 1.71 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.397 -0.815 . . . . 0.0 109.272 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.614 HG13 ' N ' ' A' ' 102' ' ' LYS . 8.6 p -46.78 -46.85 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.216 -0.928 . . . . 0.0 109.939 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.743 ' HD3' ' OE2' ' A' ' 111' ' ' GLU . 3.3 ttmt -66.31 -44.29 83.82 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.232 -0.918 . . . . 0.0 109.615 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -47.98 -68.53 0.18 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.221 -0.925 . . . . 0.0 110.153 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.682 HG21 ' HD3' ' A' ' 7' ' ' LYS . 14.5 p -74.16 42.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.185 -0.947 . . . . 0.0 110.05 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.448 HG12 ' O ' ' A' ' 102' ' ' LYS . 0.3 OUTLIER -121.0 167.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.417 -0.802 . . . . 0.0 109.712 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.577 ' C ' ' H ' ' A' ' 108' ' ' PHE . 3.1 pt20 -177.21 -29.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.671 ' ND2' ' ND2' ' A' ' 15' ' ' ASN . 1.3 m-20 -66.77 26.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.528 -0.732 . . . . 0.0 109.738 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.577 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.2 OUTLIER -139.82 154.29 47.31 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.005 -1.059 . . . . 0.0 109.478 179.367 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.43 -31.98 14.4 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.476 -0.765 . . . . 0.0 109.778 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -162.35 152.37 16.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.142 -0.974 . . . . 0.0 109.852 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.743 ' OE2' ' HD3' ' A' ' 102' ' ' LYS . 7.8 pt-20 -104.87 156.9 17.59 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.27 -0.894 . . . . 0.0 108.682 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -142.28 158.35 43.82 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.943 -1.098 . . . . 0.0 110.894 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.764 ' O ' HD13 ' A' ' 114' ' ' ILE . 4.1 p -117.01 158.12 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.764 HD13 ' O ' ' A' ' 113' ' ' VAL . 4.4 mm -138.07 154.5 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.083 -1.011 . . . . 0.0 110.314 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.63 -0.12 2.92 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.487 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -155.08 155.35 33.92 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.381 -0.824 . . . . 0.0 109.072 179.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -74.39 -24.75 59.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.093 -1.005 . . . . 0.0 109.912 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.528 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 1.0 OUTLIER -68.82 -14.52 63.08 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.135 -0.978 . . . . 0.0 109.144 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.585 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 10.2 mm-40 -87.09 4.1 43.51 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.767 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.673 HD23 HD11 ' A' ' 125' ' ' ILE . 9.2 mt -107.18 31.17 5.57 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.278 -0.889 . . . . 0.0 109.577 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.528 ' CG ' ' O ' ' A' ' 118' ' ' LYS . 1.6 mt-10 -79.27 138.08 37.63 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.044 -1.035 . . . . 0.0 109.903 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -46.0 -53.75 9.55 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.095 -1.003 . . . . 0.0 109.477 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . 0.733 ' OD1' ' N ' ' A' ' 123' ' ' ASP . 0.0 OUTLIER -60.78 -38.6 85.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.277 -0.89 . . . . 0.0 109.735 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.585 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 20.8 t80 -61.06 -48.18 82.94 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.208 -0.932 . . . . 0.0 109.157 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.673 HD11 HD23 ' A' ' 120' ' ' LEU . 2.0 mm -58.96 -21.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.562 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -82.24 -44.97 15.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.129 -0.982 . . . . 0.0 109.838 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 13.7 t -58.33 -30.94 67.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.246 -0.909 . . . . 0.0 109.842 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -85.24 -38.93 18.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.169 -0.957 . . . . 0.0 109.582 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.698 HD21 ' HB2' ' A' ' 77' ' ' ALA . 6.1 mt -68.2 -27.82 66.72 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.122 -0.986 . . . . 0.0 109.295 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -49.45 -46.39 47.82 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.172 -0.955 . . . . 0.0 109.106 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' A' ' 132' ' ' ALA . 5.0 tmtt? -169.86 -53.12 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.437 -0.79 . . . . 0.0 109.267 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 131' ' ' LYS . . . 45.62 92.95 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.44 -0.787 . . . . 0.0 109.514 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -101.89 -43.94 2.01 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.664 ' O ' ' HB3' ' A' ' 135' ' ' ALA . . . 101.89 -94.67 1.23 Allowed Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.569 -1.413 . . . . 0.0 109.569 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' A' ' 134' ' ' GLY . . . 73.38 -1.36 3.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.264 -1.139 . . . . 0.0 109.519 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.598 HD22 ' C ' ' A' ' 136' ' ' ASN . 0.4 OUTLIER -95.66 41.94 1.1 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.178 -0.952 . . . . 0.0 109.536 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.541 ' CG ' ' O ' ' A' ' 137' ' ' TYR . 66.2 t80 -144.16 29.16 1.33 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.24 -0.913 . . . . 0.0 109.484 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.432 ' CG ' ' N ' ' A' ' 139' ' ' ALA . 2.6 p-10 -162.59 -42.98 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.271 -0.893 . . . . 0.0 109.493 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.432 ' N ' ' CG ' ' A' ' 138' ' ' ASP . . . -101.15 31.87 3.48 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.561 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -50.34 -50.14 51.88 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.272 -0.892 . . . . 0.0 109.48 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.7 t -51.9 151.48 3.52 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.215 -0.928 . . . . 0.0 109.474 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.077 -0.963 . . . . 0.0 109.445 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.703 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 3.9 mtp . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 77.09 14.9 1.9 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.255 -0.903 . . . . 0.0 109.502 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 2' ' ' ALA . 4.1 m 60.83 135.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.234 -0.916 . . . . 0.0 109.412 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.63 ' CB ' HG23 ' A' ' 35' ' ' THR . 23.1 mttp -128.77 124.06 34.53 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.466 -0.771 . . . . 0.0 109.442 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.597 HD12 HG21 ' A' ' 36' ' ' ILE . 3.0 tp -107.59 130.32 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.379 -0.825 . . . . 0.0 109.476 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.5 OUTLIER -102.86 60.89 0.79 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.148 -0.97 . . . . 0.0 109.451 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.711 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -45.52 -14.11 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.065 -1.022 . . . . 0.0 109.51 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 6' ' ' ASP . 4.0 mt-10 -55.53 -50.74 69.19 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.199 -0.938 . . . . 0.0 109.443 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.29 -58.19 6.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.166 -0.959 . . . . 0.0 109.383 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.596 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.3 m -57.05 -65.17 0.66 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.195 -0.941 . . . . 0.0 109.776 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.586 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 9.7 tmm_? -44.62 -57.68 3.5 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.981 -1.075 . . . . 0.0 109.959 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.64 -33.05 53.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.169 -0.957 . . . . 0.0 109.366 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.2 -39.69 25.03 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.161 -0.962 . . . . 0.0 109.75 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.667 ' CZ ' ' CG ' ' A' ' 61' ' ' PHE . 1.5 m-85 -50.27 -49.23 53.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.23 -0.919 . . . . 0.0 110.001 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.738 ' H ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -80.13 -17.42 52.56 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.331 -0.856 . . . . 0.0 110.099 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 16' ' ' LEU . 33.1 tp -70.61 -22.72 62.51 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.06 -1.025 . . . . 0.0 109.546 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.733 HG11 ' O ' ' A' ' 25' ' ' ILE . 4.5 m -92.0 -3.09 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.243 -0.91 . . . . 0.0 109.529 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.653 HH11 ' CG ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -63.21 -4.05 2.23 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.317 -0.865 . . . . 0.0 109.382 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.559 ' C ' ' H ' ' A' ' 21' ' ' GLY . 0.7 OUTLIER -97.09 158.8 15.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.326 -0.859 . . . . 0.0 109.6 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.401 ' HA ' HH22 ' A' ' 63' ' ' ARG . 0.0 OUTLIER -68.37 16.56 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 109.536 179.895 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.559 ' H ' ' C ' ' A' ' 19' ' ' ASP . . . 147.71 75.93 0.02 OUTLIER Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.175 -1.57 . . . . 0.0 109.175 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.99 -46.2 4.95 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.266 -1.138 . . . . 0.0 109.864 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 24' ' ' VAL . . . -166.85 -141.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.036 -1.04 . . . . 0.0 110.405 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 24' ' ' VAL . 2.4 m -39.18 123.53 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.512 -0.742 . . . . 0.0 110.494 -179.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.733 ' O ' HG11 ' A' ' 17' ' ' VAL . 0.3 OUTLIER -63.09 -55.0 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 179.011 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.694 ' CE3' HG23 ' A' ' 28' ' ' THR . 17.7 p-90 -128.86 165.13 21.61 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.579 ' CG1' HG21 ' A' ' 24' ' ' VAL . 27.8 m -133.48 133.52 57.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.24 -0.912 . . . . 0.0 109.278 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.694 HG23 ' CE3' ' A' ' 26' ' ' TRP . 72.5 p -125.87 137.83 53.76 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.283 -0.885 . . . . 0.0 109.65 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.657 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.65 163.56 16.27 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 178.475 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.675 ' CG ' HH11 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -141.0 142.22 34.27 Favored 'General case' 0 C--N 1.294 -1.831 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.538 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.417 ' C ' ' O ' ' A' ' 30' ' ' ARG . 6.6 m-85 -42.76 98.55 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.486 -0.759 . . . . 0.0 109.887 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.45 ' N ' ' O ' ' A' ' 30' ' ' ARG . 1.3 t0 -97.97 101.59 13.12 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 57.68 -120.18 20.12 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.076 -1.61 . . . . 0.0 109.076 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.67 22.94 15.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -1.06 . . . . 0.0 110.292 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.63 HG23 ' CB ' ' A' ' 4' ' ' LYS . 2.8 m -143.47 134.95 26.19 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.107 -0.996 . . . . 0.0 110.014 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.597 HG21 HD12 ' A' ' 5' ' ' ILE . 1.6 mp -84.44 110.27 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.302 -0.874 . . . . 0.0 108.969 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.8 m -135.8 158.58 73.78 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.277 -0.889 . . . . 0.0 109.662 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -50.74 135.78 42.23 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.754 2.303 . . . . 0.0 111.585 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.465 ' HA3' HH11 ' A' ' 30' ' ' ARG . . . -130.4 -22.96 1.04 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.608 ' CG ' HE22 ' A' ' 51' ' ' GLN . 1.8 m-20 -142.68 -178.35 5.74 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.492 -1.005 . . . . 0.0 109.425 -179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.905 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -163.22 -176.99 5.1 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.435 -0.79 . . . . 0.0 109.764 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.407 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -157.27 141.92 8.23 Favored Glycine 0 N--CA 1.489 2.174 0 C-N-CA 119.549 -1.31 . . . . 0.0 109.9 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.3 -8.8 18.03 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -157.52 174.83 14.78 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.574 ' CZ ' ' CE2' ' A' ' 48' ' ' PHE . 31.0 t80 -73.68 -10.64 59.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.277 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.631 ' HA ' HD11 ' A' ' 49' ' ' ILE . 46.0 mm-40 -75.61 -30.29 59.51 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.187 -0.946 . . . . 0.0 110.636 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.533 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -79.36 -4.0 48.87 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 120.609 -1.307 . . . . 0.0 110.044 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.583 ' CZ ' HD13 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -83.13 -51.51 7.45 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.835 -1.166 . . . . 0.0 110.193 -179.206 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.756 HD12 ' N ' ' A' ' 49' ' ' ILE . 0.1 OUTLIER -63.03 -32.66 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 120.876 -1.14 . . . . 0.0 109.137 179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.93 -21.5 60.87 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.608 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.0 OUTLIER -96.46 -15.1 21.92 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.527 -179.187 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.565 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 7.5 m -117.92 52.44 1.0 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.414 -0.804 . . . . 0.0 110.228 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 55' ' ' ASP . 23.3 p -72.48 166.87 21.77 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.911 -1.118 . . . . 0.0 109.266 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -70.47 12.21 0.27 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 109.768 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 53' ' ' THR . 5.9 m-20 -120.49 24.82 10.15 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.398 -0.814 . . . . 0.0 109.749 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.438 HG13 ' CD1' ' A' ' 81' ' ' TRP . 6.8 p -148.11 162.79 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.184 -0.948 . . . . 0.0 109.577 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.487 ' O ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -138.38 126.09 22.24 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.261 -0.899 . . . . 0.0 110.178 -179.843 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.743 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.0 pp -172.85 173.81 3.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.165 -0.96 . . . . 0.0 110.0 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.56 ' O ' HG22 ' A' ' 28' ' ' THR . 0.6 OUTLIER -107.19 154.52 21.08 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.22 -0.925 . . . . 0.0 108.739 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.483 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -134.74 157.53 46.47 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.166 -0.959 . . . . 0.0 109.458 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.667 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 85.8 t80 -149.85 96.6 2.48 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.269 -0.895 . . . . 0.0 109.27 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -114.5 158.12 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.253 -0.904 . . . . 0.0 109.305 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.401 HH22 ' HA ' ' A' ' 20' ' ' ASP . 34.1 ttp180 -84.39 127.25 33.89 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.262 -0.899 . . . . 0.0 109.194 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -104.22 155.93 18.32 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 109.761 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.8 m -79.78 143.35 34.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.355 -0.841 . . . . 0.0 109.108 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.8 m -110.1 54.51 0.66 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.457 -0.777 . . . . 0.0 109.362 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.594 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 94.95 103.1 1.85 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.421 ' C ' ' O ' ' A' ' 67' ' ' GLY . 0.2 OUTLIER -43.14 91.46 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.206 -1.173 . . . . 0.0 109.331 -179.897 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.594 ' N ' ' O ' ' A' ' 67' ' ' GLY . . . -163.73 4.3 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.218 -0.926 . . . . 0.0 109.57 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.53 ' C ' ' H ' ' A' ' 72' ' ' LYS . 4.2 ttt 43.26 55.41 4.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.257 -0.902 . . . . 0.0 109.45 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.785 ' OG ' ' HG2' ' A' ' 73' ' ' ARG . 0.9 OUTLIER -71.08 30.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.272 -0.893 . . . . 0.0 109.514 -179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.53 ' H ' ' C ' ' A' ' 70' ' ' MET . 11.4 tttt 55.82 22.23 5.41 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.524 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.785 ' HG2' ' OG ' ' A' ' 71' ' ' SER . 11.2 ptm180 -173.02 126.48 0.45 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.25 -0.906 . . . . 0.0 109.577 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.94 -161.9 0.85 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.387 -0.821 . . . . 0.0 109.336 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.34 152.46 28.56 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.355 -0.84 . . . . 0.0 109.44 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.667 ' CD1' ' CZ ' ' A' ' 61' ' ' PHE . 1.7 m-85 -134.17 126.46 29.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.411 -0.806 . . . . 0.0 109.683 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.64 159.32 43.0 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.794 -178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.572 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -113.08 155.84 24.19 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 120' ' ' LEU . 2.0 mt -138.06 135.68 45.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.915 -1.116 . . . . 0.0 109.121 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 26.3 m -95.93 120.24 35.85 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 0.0 109.312 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.565 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 64.9 t-105 -92.86 111.32 22.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.028 -1.045 . . . . 0.0 109.878 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.9 mm -107.52 92.88 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.505 ' O ' HG23 ' A' ' 86' ' ' VAL . . . -61.64 147.36 48.15 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.19 -14.1 60.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.31 -1.112 . . . . 0.0 109.582 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -97.59 37.02 1.41 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 109.492 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 83' ' ' GLY . 43.6 t -102.79 160.47 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.646 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.477 ' N ' HG12 ' A' ' 86' ' ' VAL . 14.0 m -91.64 -170.29 2.55 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.239 -0.913 . . . . 0.0 109.373 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.89 -18.1 64.07 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 90' ' ' GLN . 8.0 mt -51.08 -69.79 0.1 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.15 -1.206 . . . . 0.0 109.5 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.552 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 0.9 OUTLIER -44.61 -33.94 1.98 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 109.292 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.45 ' HA ' ' HE ' ' A' ' 91' ' ' ARG . 1.1 tpm_? -45.62 -61.69 1.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.159 -0.963 . . . . 0.0 109.693 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.7 -37.24 42.1 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.193 -0.942 . . . . 0.0 109.487 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.413 ' O ' ' C ' ' A' ' 94' ' ' THR . 0.1 OUTLIER -64.75 -66.31 0.56 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.943 . . . . 0.0 109.834 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.499 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 95.6 m -44.74 -40.68 6.22 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.25 -0.906 . . . . 0.0 109.562 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.489 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -51.12 -57.22 11.68 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 35.0 p -67.92 -47.99 67.2 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 120.957 -1.32 . . . . 0.0 110.909 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.59 ' OD2' HD13 ' A' ' 36' ' ' ILE . 9.6 t0 -69.66 -45.37 68.53 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.816 -1.177 . . . . 0.0 111.03 -177.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.499 ' CG ' ' O ' ' A' ' 94' ' ' THR . 0.0 OUTLIER -55.38 -24.26 28.87 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.774 -1.17 . . . . 0.0 108.604 -179.734 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.3 OUTLIER -67.23 -50.24 61.43 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.338 -0.851 . . . . 0.0 108.79 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 100' ' ' LEU . 10.4 mp -51.33 -54.67 24.01 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.292 -0.88 . . . . 0.0 109.499 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.467 HG22 HD11 ' A' ' 5' ' ' ILE . 31.2 t -48.94 -74.3 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.148 -0.97 . . . . 0.0 109.945 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 101' ' ' VAL . 32.8 mtmt -43.13 -48.96 6.41 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.152 -0.968 . . . . 0.0 109.681 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.58 -57.37 12.99 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.921 . . . . 0.0 110.045 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.783 HG12 ' O ' ' A' ' 104' ' ' VAL . 97.5 t -75.56 40.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 109.911 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.461 HG12 ' O ' ' A' ' 105' ' ' VAL . 2.2 t -138.23 113.04 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.098 -1.001 . . . . 0.0 109.863 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.621 ' O ' ' N ' ' A' ' 108' ' ' PHE . 1.0 OUTLIER -124.2 -30.24 3.47 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 179.557 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 9.3 m-20 -61.21 35.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.822 -0.549 . . . . 0.0 110.214 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.621 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -149.71 -178.06 6.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.066 -1.021 . . . . 0.0 110.135 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -93.96 -62.76 1.29 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.414 -0.804 . . . . 0.0 109.925 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.534 ' NZ ' ' CB ' ' A' ' 110' ' ' LYS . 5.6 ttpm? -147.4 173.9 12.18 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.22 -0.925 . . . . 0.0 109.6 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.489 ' N ' ' CG ' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -104.62 155.43 18.85 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.208 -0.932 . . . . 0.0 109.192 179.861 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -135.43 150.67 49.91 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.272 -0.893 . . . . 0.0 110.069 -179.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.8 p -116.29 147.26 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 115' ' ' SER . 27.5 mm -138.5 156.56 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.188 -0.945 . . . . 0.0 110.375 -179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.403 ' O ' ' OG ' ' A' ' 115' ' ' SER . 0.3 OUTLIER -140.75 6.03 2.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.584 ' OD1' ' N ' ' A' ' 117' ' ' ARG . 43.3 t0 -150.14 155.36 39.67 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.866 . . . . 0.0 109.409 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.584 ' N ' ' OD1' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -79.04 -28.39 43.23 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.197 -0.939 . . . . 0.0 110.047 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -73.99 -14.74 61.07 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.994 -1.066 . . . . 0.0 109.042 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.603 ' O ' ' CD1' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -86.41 4.63 38.67 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.386 -0.821 . . . . 0.0 109.744 -179.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.796 HD23 HD11 ' A' ' 125' ' ' ILE . 7.2 mt -114.12 29.48 7.98 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.362 -0.837 . . . . 0.0 109.652 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 122' ' ' GLU . 4.0 mm-40 -76.83 141.83 40.51 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.351 -0.843 . . . . 0.0 109.287 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' A' ' 121' ' ' GLU . 1.3 mt-10 -41.31 -52.4 3.46 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.187 -0.945 . . . . 0.0 109.742 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.2 -10.88 45.81 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.307 -0.87 . . . . 0.0 110.868 -179.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.603 ' CD1' ' O ' ' A' ' 119' ' ' GLU . 18.0 t80 -86.34 -48.81 8.15 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.737 -1.227 . . . . 0.0 109.359 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.796 HD11 HD23 ' A' ' 120' ' ' LEU . 4.1 mm -76.24 -20.56 15.25 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.411 HH21 ' HA2' ' A' ' 67' ' ' GLY . 61.7 ttt180 -73.34 -53.35 10.99 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.27 -0.894 . . . . 0.0 108.951 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.65 -18.66 65.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.315 -0.866 . . . . 0.0 109.315 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.404 ' CG ' ' O ' ' A' ' 124' ' ' PHE . 5.7 mm-40 -72.36 -43.09 64.53 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.228 -0.92 . . . . 0.0 109.191 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.563 ' C ' ' H ' ' A' ' 131' ' ' LYS . 9.1 mt -66.51 -36.39 82.59 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -55.39 -4.67 0.1 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.563 ' H ' ' C ' ' A' ' 129' ' ' LEU . 12.8 ttpt 61.37 104.45 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 CA-C-O 121.72 0.771 . . . . 0.0 109.395 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -159.96 31.11 0.18 Allowed 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.61 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -141.27 -68.99 0.03 OUTLIER Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 75.4 138.14 0.63 Allowed Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.454 ' O ' ' O ' ' A' ' 136' ' ' ASN . . . -145.27 68.9 1.23 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.235 -1.156 . . . . 0.0 109.476 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.601 ' N ' ' ND2' ' A' ' 136' ' ' ASN . 0.3 OUTLIER 49.31 96.95 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.237 -0.915 . . . . 0.0 109.454 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -140.8 -35.81 0.48 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.323 -0.861 . . . . 0.0 109.438 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -143.6 40.65 1.43 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.297 -0.877 . . . . 0.0 109.45 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -149.86 37.56 0.72 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.295 -0.878 . . . . 0.0 109.453 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -69.79 101.17 1.65 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.238 -0.914 . . . . 0.0 109.45 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.67 -12.61 60.79 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.279 -0.888 . . . . 0.0 109.473 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.437 179.978 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.678 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.678 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 76.05 159.32 0.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.419 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m -158.02 147.57 19.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.21 -0.932 . . . . 0.0 109.457 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 35' ' ' THR . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.724 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.621 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.578 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.801 HD22 HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -79.65 -7.96 58.9 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.574 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -92.34 158.09 16.28 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.24 -0.913 . . . . 0.0 109.444 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.69 38.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.202 -0.936 . . . . 0.0 109.815 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . 174.35 -91.77 0.09 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.729 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.7 OUTLIER 74.15 -55.11 0.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -1.064 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.729 ' HB3' ' O ' ' A' ' 22' ' ' SER . . . 84.16 52.82 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.804 HG22 ' O ' ' A' ' 24' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.709 HG22 ' O ' ' A' ' 42' ' ' GLY . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.688 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.621 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.771 ' OH ' HG23 ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.544 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.709 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.446 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.591 ' O ' HG23 ' A' ' 53' ' ' THR . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.3 mm100 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.463 ' SG ' HD21 ' A' ' 120' ' ' LEU . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.521 ' H ' ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.553 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.825 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.633 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER -109.82 77.29 1.04 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.1 130.36 4.24 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.737 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 0.0 OUTLIER -79.08 91.66 4.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -1.133 . . . . 0.0 109.481 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.7 ' HB2' ' O ' ' A' ' 68' ' ' ASP . . . 164.83 132.08 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.23 -0.919 . . . . 0.0 109.445 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.552 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 6.3 tpt 54.88 -82.78 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.46 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.578 ' N ' ' O ' ' A' ' 69' ' ' ALA . 1.7 m 54.01 80.27 0.12 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.42 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -86.53 -11.39 51.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.235 -0.916 . . . . 0.0 109.56 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.8 mtt180 -159.33 96.27 1.29 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.248 -0.907 . . . . 0.0 109.634 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.825 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -50.45 -178.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.714 ' HD3' HD13 ' A' ' 129' ' ' LEU . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.454 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.62 ' CG2' HD12 ' A' ' 114' ' ' ILE . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.441 HG23 ' CD2' ' A' ' 59' ' ' PHE . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 80' ' ' THR . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.525 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' THR . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.771 HG23 ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' ALA . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.415 ' OD2' HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 104' ' ' VAL . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.427 ' O ' HG12 ' A' ' 105' ' ' VAL . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.801 HD22 HD22 ' A' ' 15' ' ' ASN . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.62 HD12 ' CG2' ' A' ' 79' ' ' ILE . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.661 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.714 HD13 ' HD3' ' A' ' 75' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.33 -7.73 0.26 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.549 ' H ' ' C ' ' A' ' 129' ' ' LEU . 7.3 ttpp 61.26 104.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.797 0.808 . . . . 0.0 109.338 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -139.25 -32.35 0.66 Allowed 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -47.33 162.43 0.26 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -137.58 167.15 24.88 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . -162.87 24.47 0.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -1.164 . . . . 0.0 109.501 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.552 ' N ' ' ND2' ' A' ' 136' ' ' ASN . 0.6 OUTLIER 65.94 -74.02 0.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 109.567 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' ALA . 74.4 t80 53.05 6.74 0.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.276 -0.89 . . . . 0.0 109.438 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.503 ' H ' ' C ' ' A' ' 136' ' ' ASN . 12.6 t0 -165.29 -87.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -145.86 83.48 1.64 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.527 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 48.84 -99.52 0.06 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.241 -0.912 . . . . 0.0 109.432 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -173.36 4.06 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.911 . . . . 0.0 109.438 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.515 -179.982 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.0 mmt . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.401 ' H ' ' H ' ' A' ' 3' ' ' THR . . . -158.37 -18.42 0.08 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.259 -0.901 . . . . 0.0 109.442 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.401 ' H ' ' H ' ' A' ' 2' ' ' ALA . 0.3 OUTLIER -95.54 145.78 24.95 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.335 -0.853 . . . . 0.0 109.455 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -139.61 118.44 12.45 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.236 -0.915 . . . . 0.0 109.47 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.506 HG23 ' HG3' ' A' ' 7' ' ' LYS . 1.3 tt -113.84 147.21 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.522 -0.736 . . . . 0.0 109.653 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -94.37 63.0 2.97 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.218 -0.926 . . . . 0.0 109.111 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.746 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.49 -26.16 60.86 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.227 -0.921 . . . . 0.0 109.55 -179.705 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -53.87 -46.6 71.36 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.278 -0.889 . . . . 0.0 109.407 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -60.86 -68.12 0.34 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.947 . . . . 0.0 109.582 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.652 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.76 -58.9 2.79 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.164 -0.96 . . . . 0.0 109.859 -179.726 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.652 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 8.5 ttt180 -44.41 -59.57 2.35 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.925 -1.109 . . . . 0.0 110.219 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.75 -37.0 65.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.202 -0.937 . . . . 0.0 110.038 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.483 ' CB ' HG11 ' A' ' 27' ' ' VAL . . . -83.6 -19.17 36.0 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.096 -1.003 . . . . 0.0 110.117 -179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.505 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.0 m-85 -72.62 -53.89 10.62 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.111 -0.993 . . . . 0.0 109.569 -179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.715 ' ND2' HD22 ' A' ' 107' ' ' ASN . 1.7 m-80 -68.51 -25.68 65.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.221 -0.924 . . . . 0.0 109.547 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.524 ' O ' ' CB ' ' A' ' 22' ' ' SER . 1.3 tp -57.64 -61.33 2.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.233 -0.917 . . . . 0.0 109.329 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 14' ' ' TYR . 21.4 m -51.84 -19.41 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 109.733 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.448 ' HD2' ' CE ' ' A' ' 72' ' ' LYS . 8.0 ttm180 -56.19 -31.22 63.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.169 -0.957 . . . . 0.0 109.507 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -75.1 160.27 30.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.571 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -63.92 60.43 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.308 -0.87 . . . . 0.0 109.614 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.588 ' O ' ' N ' ' A' ' 23' ' ' ALA . . . 133.59 -73.56 0.45 Allowed Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.154 -1.578 . . . . 0.0 109.154 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.729 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.6 OUTLIER 54.31 -82.12 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.531 -0.982 . . . . 0.0 109.457 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 161.12 -172.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.509 -0.744 . . . . 0.0 109.389 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.494 ' C ' ' O ' ' A' ' 23' ' ' ALA . 4.8 m 31.94 74.82 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.846 -0.534 . . . . 0.0 110.686 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.754 HG22 ' O ' ' A' ' 42' ' ' GLY . 6.3 tt -44.49 -38.4 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.089 -1.007 . . . . 0.0 108.514 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.753 ' CD1' HG23 ' A' ' 25' ' ' ILE . 43.5 p-90 -150.57 162.51 40.5 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.397 -0.814 . . . . 0.0 109.25 178.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.483 HG11 ' CB ' ' A' ' 13' ' ' ALA . 26.8 m -133.26 139.4 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 109.187 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.584 HG23 ' CE3' ' A' ' 26' ' ' TRP . 60.7 p -128.98 139.93 51.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.34 -0.85 . . . . 0.0 110.179 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.18 133.36 51.58 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 16.9 ptt180 -108.59 147.41 31.85 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.852 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.475 ' HH ' ' CG ' ' A' ' 97' ' ' ASP . 14.5 m-85 -47.55 98.66 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.565 -0.709 . . . . 0.0 109.766 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -96.02 101.97 13.7 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.7 -120.23 21.47 Favored Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.188 -1.565 . . . . 0.0 109.188 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.99 22.25 16.23 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.326 -1.103 . . . . 0.0 110.228 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.0 m -145.33 136.99 25.35 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 109.812 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.805 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.9 mp -81.62 114.35 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.221 -0.924 . . . . 0.0 108.979 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.413 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -135.46 152.0 75.7 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 109.717 -179.56 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.413 ' C ' ' O ' ' A' ' 37' ' ' VAL . 97.0 Cg_exo -33.12 145.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.396 0 C-N-CA 122.971 2.447 . . . . 0.0 112.252 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -137.44 -36.45 0.17 Allowed Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.653 ' CG ' HE22 ' A' ' 51' ' ' GLN . 2.7 m-20 -142.67 -179.81 6.54 Favored 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.731 -0.864 . . . . 0.0 109.419 -179.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.848 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -157.03 179.8 8.94 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.995 -178.363 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.754 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.27 133.09 2.89 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.45 -3.04 24.52 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.82 175.97 12.92 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.155 -1.424 . . . . 0.0 107.155 178.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.73 -42.42 70.55 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 120.677 -1.264 . . . . 0.0 108.946 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.489 ' NE2' ' N ' ' A' ' 46' ' ' GLN . 0.7 OUTLIER -43.09 -35.54 1.34 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.305 -0.872 . . . . 0.0 110.674 -179.328 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.536 ' CE1' ' OE1' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -62.95 -22.56 66.88 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.013 -1.054 . . . . 0.0 109.532 -179.565 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.553 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -68.44 -23.97 64.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.202 -0.936 . . . . 0.0 108.718 179.489 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.522 ' C ' ' H ' ' A' ' 51' ' ' GLN . 7.4 mt -76.57 -54.02 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.582 -0.699 . . . . 0.0 109.927 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.455 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.0 OUTLIER -65.56 -2.94 3.83 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 179.413 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.653 HE22 ' CG ' ' A' ' 40' ' ' ASP . 1.1 mm100 -106.13 -37.54 6.56 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.11 -178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.595 ' O ' HG23 ' A' ' 53' ' ' THR . 0.1 OUTLIER -49.32 132.43 20.12 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.287 -0.883 . . . . 0.0 109.644 -179.83 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.595 HG23 ' O ' ' A' ' 52' ' ' CYS . 20.6 p -160.07 115.29 2.34 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.4 -0.813 . . . . 0.0 110.555 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.74 11.36 0.1 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.628 -0.67 . . . . 0.0 109.587 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.538 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.1 OUTLIER -122.71 16.68 10.28 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.495 -0.753 . . . . 0.0 109.324 179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.532 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.3 OUTLIER -135.72 154.26 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.4 -0.813 . . . . 0.0 109.574 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.728 ' H ' ' NE ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.59 131.73 43.52 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.355 -0.841 . . . . 0.0 109.519 -179.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.765 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.8 pp -172.69 172.39 4.2 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.974 -1.078 . . . . 0.0 110.317 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.567 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 2.2 m-85 -106.01 153.96 21.29 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -135.83 156.9 48.09 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.02 -1.05 . . . . 0.0 109.556 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 53.9 t80 -148.19 97.57 2.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.358 -0.839 . . . . 0.0 109.21 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.503 ' O ' ' CE1' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -115.74 150.97 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.323 -0.861 . . . . 0.0 109.08 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.5 ttp180 -80.47 108.6 14.24 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.276 -0.89 . . . . 0.0 108.96 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.503 ' CE1' ' O ' ' A' ' 62' ' ' VAL . 14.9 m-85 -86.72 155.76 20.23 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.324 -0.86 . . . . 0.0 109.805 -179.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.55 161.04 28.19 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.298 -0.876 . . . . 0.0 108.848 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.9 t -109.75 43.8 1.28 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.385 -0.822 . . . . 0.0 109.466 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.676 ' N ' ' NZ ' ' A' ' 130' ' ' LYS . . . 84.61 -69.49 3.32 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -137.43 80.98 1.84 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.286 -1.126 . . . . 0.0 109.489 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.89 159.0 0.19 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.241 -0.912 . . . . 0.0 109.482 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.722 ' O ' ' OG ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -138.21 1.78 2.25 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.267 -0.896 . . . . 0.0 109.434 179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.722 ' OG ' ' O ' ' A' ' 70' ' ' MET . 4.8 m 163.04 -110.52 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.334 -0.854 . . . . 0.0 109.461 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.448 ' CE ' ' HD2' ' A' ' 18' ' ' ARG . 20.7 tttt -103.32 80.57 1.84 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.243 -0.91 . . . . 0.0 109.451 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 -138.75 -91.13 0.2 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.309 -0.87 . . . . 0.0 109.478 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.27 167.07 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.2 -0.938 . . . . 0.0 109.438 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.647 ' HD2' HD22 ' A' ' 129' ' ' LEU . 2.6 mmtp -104.59 154.98 19.25 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.375 -0.828 . . . . 0.0 109.846 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.582 ' O ' ' N ' ' A' ' 109' ' ' ALA . 84.3 m-85 -133.22 118.8 19.04 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.151 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.426 ' HB1' ' O ' ' A' ' 110' ' ' LYS . . . -144.36 167.18 23.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.139 -0.976 . . . . 0.0 111.024 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.436 ' HG ' ' N ' ' A' ' 79' ' ' ILE . 9.2 tp -111.87 151.64 28.87 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.568 HG23 HG12 ' A' ' 114' ' ' ILE . 22.1 mt -130.35 129.54 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 120.99 -1.069 . . . . 0.0 108.758 179.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.476 HG22 HD11 ' A' ' 82' ' ' ILE . 5.7 m -95.86 115.05 26.86 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.532 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 62.8 t-105 -92.97 111.23 22.78 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.101 -0.999 . . . . 0.0 109.651 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.476 HD11 HG22 ' A' ' 80' ' ' THR . 24.9 mm -104.1 93.19 2.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 108.906 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.59 137.6 39.7 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -79.55 53.22 1.53 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.286 -1.126 . . . . 0.0 109.653 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -141.22 -30.99 0.6 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.17 -0.956 . . . . 0.0 109.81 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.463 HG21 ' NE2' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -64.83 156.81 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.188 -0.945 . . . . 0.0 109.623 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.453 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 54.9 p -96.04 -127.89 0.14 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.363 -0.836 . . . . 0.0 109.587 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.453 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.17 -18.33 63.01 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.53 ' O ' ' CG ' ' A' ' 93' ' ' LYS . 3.4 mt -46.14 -48.9 17.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.971 -1.311 . . . . 0.0 109.934 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.463 ' NE2' HG21 ' A' ' 86' ' ' VAL . 3.1 pt20 -66.03 -26.39 67.49 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.145 -0.972 . . . . 0.0 109.908 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -56.39 -67.2 0.32 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.966 -1.084 . . . . 0.0 110.188 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.77 -44.43 49.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.18 -0.95 . . . . 0.0 110.131 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.53 ' CG ' ' O ' ' A' ' 89' ' ' LEU . 12.3 mmtm -55.82 -65.19 0.64 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.208 -0.933 . . . . 0.0 110.102 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.545 ' O ' ' CG ' ' A' ' 98' ' ' LYS . 8.0 m -50.78 -49.68 57.75 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.131 -0.981 . . . . 0.0 109.679 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -46.94 -61.1 4.58 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 m -63.91 -51.12 65.94 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.031 -1.276 . . . . 0.0 111.78 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.588 ' OD1' ' N ' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -74.57 -39.76 62.07 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.725 -1.234 . . . . 0.0 111.784 -177.183 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.588 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -55.36 -26.36 40.65 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 120.585 -1.322 . . . . 0.0 108.642 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -78.45 -30.34 47.42 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 97' ' ' ASP . 2.0 mt -71.18 -64.57 0.89 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.439 -0.788 . . . . 0.0 109.339 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.603 HG13 ' N ' ' A' ' 102' ' ' LYS . 9.9 p -41.9 -45.46 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.209 -0.932 . . . . 0.0 110.008 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.603 ' N ' HG13 ' A' ' 101' ' ' VAL . 6.1 ttpt -65.99 -39.4 90.28 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.271 -0.893 . . . . 0.0 109.597 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -60.66 -51.27 70.11 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.251 -0.906 . . . . 0.0 110.156 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.639 HG12 ' O ' ' A' ' 104' ' ' VAL . 40.2 t -77.64 38.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.099 -1.001 . . . . 0.0 109.954 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.507 HG12 ' O ' ' A' ' 102' ' ' LYS . 1.7 p -112.57 136.55 48.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.338 -0.851 . . . . 0.0 109.513 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -145.65 24.67 1.36 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.373 -0.829 . . . . 0.0 108.928 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.715 HD22 ' ND2' ' A' ' 15' ' ' ASN . 2.8 t-20 -135.39 -25.32 1.33 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.432 -0.792 . . . . 0.0 110.141 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.2 OUTLIER -76.86 171.1 15.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.388 -179.561 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -117.79 -31.74 5.04 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.77 ' HE2' ' CE1' ' A' ' 112' ' ' PHE . 3.2 ttpm? -162.46 152.05 15.89 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.507 -0.746 . . . . 0.0 109.16 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -104.43 155.45 18.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.127 -0.983 . . . . 0.0 109.088 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.77 ' CE1' ' HE2' ' A' ' 110' ' ' LYS . 9.4 m-85 -133.88 156.44 48.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.366 -0.834 . . . . 0.0 109.819 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.765 ' O ' HG13 ' A' ' 113' ' ' VAL . 13.0 p -113.44 97.41 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.695 HG23 ' HB3' ' A' ' 119' ' ' GLU . 30.4 mm -100.32 142.44 15.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.228 -0.92 . . . . 0.0 109.888 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.1 m -141.1 15.6 2.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.308 -0.87 . . . . 0.0 109.548 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.9 155.34 46.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.034 -1.041 . . . . 0.0 110.124 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -69.71 -36.25 75.74 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.374 -0.829 . . . . 0.0 109.709 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -76.3 -17.36 59.48 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.695 ' HB3' HG23 ' A' ' 114' ' ' ILE . 15.3 mm-40 -83.25 -15.84 48.71 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.475 ' HG ' HG21 ' A' ' 114' ' ' ILE . 0.5 OUTLIER -103.44 30.95 4.62 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.736 ' CG ' ' H ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -74.54 -175.31 2.35 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.448 0.642 . . . . 0.0 110.367 -179.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.476 ' C ' ' OE2' ' A' ' 121' ' ' GLU . 0.7 OUTLIER -84.06 -44.65 13.88 Favored 'General case' 0 C--N 1.295 -1.771 0 O-C-N 121.36 -0.838 . . . . 0.0 110.145 177.272 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . 0.563 ' OD1' ' N ' ' A' ' 124' ' ' PHE . 0.0 OUTLIER -85.79 -44.89 12.11 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 114.884 1.438 . . . . 0.0 114.884 -175.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.736 ' H ' ' CG ' ' A' ' 121' ' ' GLU . 18.9 t80 -49.94 -40.79 44.79 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 119.874 -1.766 . . . . 0.0 108.93 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.573 ' H ' ' CD ' ' A' ' 121' ' ' GLU . 1.1 mm -78.21 -27.17 14.53 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 C-N-CA 120.051 -0.66 . . . . 0.0 109.831 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.451 ' HG2' ' HZ3' ' A' ' 130' ' ' LYS . 25.4 ttp180 -67.48 -45.66 75.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.981 -1.074 . . . . 0.0 109.719 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.534 ' O ' ' N ' ' A' ' 130' ' ' LYS . 0.8 OUTLIER -63.2 -66.51 0.53 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.488 ' CD ' ' CE2' ' A' ' 112' ' ' PHE . 24.0 pt-20 -41.97 -33.2 0.52 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.489 -0.757 . . . . 0.0 109.318 -178.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.647 HD22 ' HD2' ' A' ' 75' ' ' LYS . 4.8 mt -79.08 -32.17 44.64 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.111 -0.993 . . . . 0.0 109.056 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.676 ' NZ ' ' N ' ' A' ' 67' ' ' GLY . 14.2 mttp -69.17 -32.11 71.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.261 -0.9 . . . . 0.0 108.951 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.719 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 0.3 OUTLIER -53.08 -65.85 0.49 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.29 -0.881 . . . . 0.0 109.523 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.719 ' HB3' ' O ' ' A' ' 131' ' ' LYS . . . 76.97 -27.83 0.18 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.264 -0.897 . . . . 0.0 109.504 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.583 ' O ' ' N ' ' A' ' 135' ' ' ALA . . . 67.23 29.76 74.74 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.437 ' C ' ' O ' ' A' ' 133' ' ' GLY . . . 43.1 -91.84 0.01 OUTLIER Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.583 ' N ' ' O ' ' A' ' 133' ' ' GLY . . . -157.28 -60.91 0.09 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.295 -1.121 . . . . 0.0 109.528 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -143.45 -136.5 0.1 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.243 -0.911 . . . . 0.0 109.452 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.505 ' O ' ' CD2' ' A' ' 137' ' ' TYR . 58.5 t80 55.93 26.57 9.96 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.277 -0.889 . . . . 0.0 109.453 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 139' ' ' ALA . 16.8 p-10 -166.17 23.25 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.27 -0.894 . . . . 0.0 109.493 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.435 ' C ' ' O ' ' A' ' 138' ' ' ASP . . . -43.38 -60.43 1.72 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.315 -0.866 . . . . 0.0 109.544 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -145.44 93.47 2.37 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.23 -0.918 . . . . 0.0 109.531 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.5 t -147.05 1.91 0.77 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.243 -0.911 . . . . 0.0 109.494 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.458 -179.949 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.472 ' O ' ' O ' ' A' ' 3' ' ' THR . . . -93.68 117.19 29.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.171 -0.956 . . . . 0.0 109.41 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.472 ' O ' ' O ' ' A' ' 2' ' ' ALA . 0.2 OUTLIER 60.45 137.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.216 -0.928 . . . . 0.0 109.444 179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.475 ' CB ' HG23 ' A' ' 35' ' ' THR . 11.0 mmtm -133.49 121.79 22.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.38 -0.825 . . . . 0.0 109.314 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.461 HG23 ' H ' ' A' ' 7' ' ' LYS . 2.2 tp -107.44 136.18 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.408 -0.807 . . . . 0.0 109.747 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 8' ' ' GLU . 1.9 p-10 -97.84 41.84 1.11 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.274 -0.891 . . . . 0.0 109.041 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.652 ' NZ ' HG13 ' A' ' 101' ' ' VAL . 1.3 mmtm -42.01 -18.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.346 -0.846 . . . . 0.0 109.898 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.582 ' N ' ' O ' ' A' ' 6' ' ' ASP . 3.5 mt-10 -51.96 -35.65 46.83 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.201 -0.937 . . . . 0.0 109.484 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.411 ' O ' ' C ' ' A' ' 10' ' ' CYS . . . -75.81 -63.67 1.25 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.863 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.65 ' SG ' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -44.49 -57.96 3.26 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.09 -1.006 . . . . 0.0 109.888 -179.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.65 ' N ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -44.16 -59.58 2.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.997 -1.064 . . . . 0.0 110.001 -179.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.9 -37.22 71.11 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.128 -0.983 . . . . 0.0 109.632 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.452 ' CB ' HG11 ' A' ' 27' ' ' VAL . . . -81.13 -11.13 59.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.12 -0.988 . . . . 0.0 109.852 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.476 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -81.88 -51.85 7.68 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.11 -0.994 . . . . 0.0 109.734 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.618 ' H ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -77.72 -11.25 59.86 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.247 -0.908 . . . . 0.0 109.64 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.479 ' C ' ' H ' ' A' ' 18' ' ' ARG . 58.3 tp -78.41 -50.06 12.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.207 -0.933 . . . . 0.0 109.34 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.9 m -57.87 -2.87 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.306 -0.871 . . . . 0.0 109.484 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.479 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -79.51 17.41 0.87 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.254 -0.904 . . . . 0.0 109.447 179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.593 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -103.5 146.84 27.92 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.338 -0.851 . . . . 0.0 109.491 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.487 ' N ' ' OD1' ' A' ' 20' ' ' ASP . 12.5 p30 -62.27 68.41 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.318 -0.864 . . . . 0.0 109.624 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . 86.16 70.84 1.31 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.712 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -100.88 -61.8 1.32 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -1.109 . . . . 0.0 109.421 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.712 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 163.5 169.47 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.0 109.472 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.816 ' O ' HG12 ' A' ' 24' ' ' VAL . 55.7 t 53.02 57.16 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.269 -0.894 . . . . 0.0 109.482 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.79 HG23 ' CD1' ' A' ' 26' ' ' TRP . 6.9 tt -47.16 -36.45 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.906 -1.121 . . . . 0.0 108.865 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.79 ' CD1' HG23 ' A' ' 25' ' ' ILE . 57.9 p-90 -148.27 151.57 35.66 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.784 -1.197 . . . . 0.0 109.671 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.452 HG11 ' CB ' ' A' ' 13' ' ' ALA . 2.4 m -112.35 163.36 9.45 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.31 -0.869 . . . . 0.0 109.701 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.463 HG22 HD23 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -145.47 129.37 17.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.177 -0.952 . . . . 0.0 110.482 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -126.97 119.66 27.21 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 178.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 32' ' ' ASP . 25.0 ptt180 -101.73 144.83 29.94 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.418 -0.801 . . . . 0.0 109.839 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -48.44 98.55 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.532 -0.73 . . . . 0.0 109.753 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.4 OUTLIER -92.67 101.95 14.36 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 178.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.95 -119.28 15.55 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.094 -1.603 . . . . 0.0 109.094 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.34 24.95 12.26 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.546 -0.973 . . . . 0.0 110.146 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.475 HG23 ' CB ' ' A' ' 4' ' ' LYS . 11.4 m -146.36 132.59 19.46 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.151 -0.968 . . . . 0.0 109.982 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.741 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.5 mp -79.95 113.12 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.175 -0.953 . . . . 0.0 108.515 179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.46 152.13 75.92 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.196 -0.94 . . . . 0.0 110.16 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_exo -34.78 141.6 0.08 OUTLIER 'Trans proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.903 2.402 . . . . 0.0 112.471 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.78 -37.88 0.28 Allowed Glycine 0 N--CA 1.488 2.167 0 N-CA-C 108.493 -1.843 . . . . 0.0 108.493 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -143.54 -179.49 6.47 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.661 ' CD ' ' H ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -130.79 -165.32 1.54 Allowed 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 121.49 0.662 . . . . 0.0 109.92 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.725 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -139.36 101.61 0.32 Allowed Glycine 0 C--N 1.299 -1.497 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.531 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -136.9 50.99 1.99 Allowed 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.531 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 3.6 m-20 155.63 106.89 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.68 ' OH ' ' HE1' ' A' ' 64' ' ' PHE . 23.0 t80 -53.78 -14.69 1.0 Allowed 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.403 ' N ' ' C ' ' A' ' 44' ' ' ASP . 43.5 mm-40 -85.15 -40.73 16.4 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.012 -1.055 . . . . 0.0 109.893 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.4 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 0.2 OUTLIER -61.66 -37.15 82.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.306 -0.872 . . . . 0.0 110.334 -179.105 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.623 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -59.12 -47.68 84.37 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 120.849 -1.157 . . . . 0.0 108.468 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.53 ' N ' ' CG ' ' A' ' 48' ' ' PHE . 1.7 mt -47.09 -43.72 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.396 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.414 ' O ' ' CD ' ' A' ' 50' ' ' GLN . 1.9 pp0? -85.77 -10.06 56.13 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.95 -1.094 . . . . 0.0 110.481 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -86.95 8.15 24.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.96 -1.088 . . . . 0.0 109.771 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.581 ' O ' ' CZ2' ' A' ' 81' ' ' TRP . 4.8 p -130.7 55.09 1.85 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.341 -0.849 . . . . 0.0 109.477 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.554 ' C ' ' H ' ' A' ' 55' ' ' ASP . 9.5 p -73.45 159.48 33.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -0.945 . . . . 0.0 109.854 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.17 8.72 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.835 . . . . 0.0 110.156 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.554 ' H ' ' C ' ' A' ' 53' ' ' THR . 44.4 m-20 -116.84 21.8 13.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 109.57 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.524 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.2 OUTLIER -144.7 157.69 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.209 -0.932 . . . . 0.0 109.772 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.664 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -136.23 116.44 13.49 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.403 -0.81 . . . . 0.0 109.225 179.517 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.692 HD22 ' C ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -159.68 175.47 13.14 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.961 -1.087 . . . . 0.0 111.125 -179.357 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.709 ' HB3' HD11 ' A' ' 78' ' ' LEU . 3.5 m-85 -109.84 151.4 27.07 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 178.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.899 ' O ' HD12 ' A' ' 78' ' ' LEU . . . -134.37 154.61 51.26 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.896 -1.128 . . . . 0.0 109.349 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.442 ' CG ' ' CZ ' ' A' ' 14' ' ' TYR . 47.3 t80 -148.8 99.14 2.95 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.076 -1.015 . . . . 0.0 108.926 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -118.86 152.66 21.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.798 0 O-C-N 121.382 -0.824 . . . . 0.0 108.976 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.476 HH11 ' HG3' ' A' ' 63' ' ' ARG . 0.4 OUTLIER -84.47 123.37 30.19 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.403 -0.811 . . . . 0.0 109.053 179.461 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.68 ' HE1' ' OH ' ' A' ' 45' ' ' TYR . 94.1 m-85 -108.14 156.23 19.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.415 -0.803 . . . . 0.0 109.356 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.505 HG22 ' N ' ' A' ' 66' ' ' THR . 98.2 m -78.49 161.01 27.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.153 -0.967 . . . . 0.0 109.12 179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.505 ' N ' HG22 ' A' ' 65' ' ' THR . 13.6 t -109.92 159.81 16.93 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.383 -0.823 . . . . 0.0 109.454 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.459 ' O ' ' O ' ' A' ' 66' ' ' THR . . . -51.46 -100.29 0.01 OUTLIER Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -138.1 43.18 2.22 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.254 -1.145 . . . . 0.0 109.453 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -101.25 129.76 47.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.921 . . . . 0.0 109.456 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.434 ' SD ' ' N ' ' A' ' 70' ' ' MET . 2.2 mpt? -71.39 -34.38 70.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.208 -0.933 . . . . 0.0 109.459 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.5 t -73.03 161.05 31.13 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.206 -0.934 . . . . 0.0 109.439 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' A' ' 73' ' ' ARG . 8.1 mmtp 53.45 51.21 15.74 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.212 -0.93 . . . . 0.0 109.479 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.492 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.9 tpt180 -43.7 130.75 5.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.252 -0.905 . . . . 0.0 109.417 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 73' ' ' ARG . 0.4 OUTLIER 57.71 154.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.225 -0.922 . . . . 0.0 109.448 -179.917 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.643 ' HD2' HD22 ' A' ' 129' ' ' LEU . 5.0 mmtm -105.86 143.62 33.75 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.325 -0.859 . . . . 0.0 109.71 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.419 ' O ' ' N ' ' A' ' 109' ' ' ALA . 90.9 m-85 -133.53 117.74 17.48 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.362 -0.836 . . . . 0.0 109.121 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.571 ' HB1' ' O ' ' A' ' 110' ' ' LYS . . . -144.38 167.74 21.75 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.018 -1.051 . . . . 0.0 111.3 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.899 HD12 ' O ' ' A' ' 60' ' ' ALA . 25.1 tp -114.16 156.48 24.16 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.497 HD11 HD12 ' A' ' 125' ' ' ILE . 6.6 mt -136.23 130.85 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.101 -0.999 . . . . 0.0 108.924 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.542 HG22 HD11 ' A' ' 82' ' ' ILE . 0.2 OUTLIER -95.84 114.58 26.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.186 -0.946 . . . . 0.0 109.84 -179.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.673 ' C ' HD13 ' A' ' 82' ' ' ILE . 65.5 t-105 -93.35 112.38 24.28 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.228 -0.92 . . . . 0.0 109.579 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.673 HD13 ' C ' ' A' ' 81' ' ' TRP . 0.9 OUTLIER -114.81 93.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.463 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -48.21 156.39 1.12 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.54 -7.39 38.06 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.262 -1.14 . . . . 0.0 109.698 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -102.9 21.11 16.2 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.227 -0.921 . . . . 0.0 109.583 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.878 HG12 ' H ' ' A' ' 87' ' ' SER . 4.8 t -86.28 -141.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.457 0 O-C-N 121.255 -0.903 . . . . 0.0 109.467 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.878 ' H ' HG12 ' A' ' 86' ' ' VAL . 10.0 m -150.27 -146.45 0.2 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.49 -0.756 . . . . 0.0 109.164 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.468 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -83.92 -17.28 65.76 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.736 -1.346 . . . . 0.0 109.736 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 90' ' ' GLN . 6.1 mp -46.5 -69.88 0.12 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.178 -1.189 . . . . 0.0 109.802 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.566 ' OE1' ' N ' ' A' ' 90' ' ' GLN . 3.3 mp0 -44.55 -29.65 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.121 -0.987 . . . . 0.0 109.229 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.468 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 0.2 OUTLIER -54.37 -64.5 0.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.12 -0.987 . . . . 0.0 109.737 -179.659 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 -44.11 38.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.161 -0.962 . . . . 0.0 109.707 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.35 -65.95 0.6 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.227 -0.921 . . . . 0.0 110.069 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.406 ' CB ' ' O ' ' A' ' 90' ' ' GLN . 2.1 m -51.86 -54.44 29.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.155 -0.966 . . . . 0.0 109.216 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.41 ' O ' ' OG1' ' A' ' 99' ' ' THR . . . -43.96 -62.84 2.5 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 p -64.58 -50.32 67.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.184 -1.186 . . . . 0.0 111.164 -178.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.435 ' HA ' HD12 ' A' ' 100' ' ' LEU . 2.9 m-20 -66.46 -40.2 89.25 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.782 -1.199 . . . . 0.0 111.693 -177.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.62 -24.52 65.57 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 120.628 -1.295 . . . . 0.0 109.119 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 95' ' ' GLY . 0.2 OUTLIER -77.69 -39.42 44.82 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' A' ' 101' ' ' VAL . 11.6 mt -64.38 -61.46 2.21 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.404 -0.81 . . . . 0.0 109.044 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.652 HG13 ' NZ ' ' A' ' 7' ' ' LYS . 42.7 t -38.88 -55.83 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.457 -0.777 . . . . 0.0 110.262 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 103' ' ' GLU . 76.9 tttt -65.39 -43.56 90.28 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.105 -0.997 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.425 ' C ' ' O ' ' A' ' 102' ' ' LYS . 1.4 tt0 -36.58 -33.64 0.05 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.487 -0.758 . . . . 0.0 111.293 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.755 HG22 ' O ' ' A' ' 104' ' ' VAL . 10.9 p -127.51 34.91 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.107 -0.996 . . . . 0.0 110.839 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.509 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 0.6 OUTLIER -115.07 119.9 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.93 . . . . 0.0 109.018 179.063 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.04 -27.58 1.82 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.248 -0.908 . . . . 0.0 109.388 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -51.89 -34.51 41.57 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.301 -0.874 . . . . 0.0 109.289 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.412 ' CE1' HG13 ' A' ' 105' ' ' VAL . 0.3 OUTLIER -70.12 -176.49 1.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.156 -0.965 . . . . 0.0 109.782 179.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -125.01 -29.41 3.34 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.521 -0.737 . . . . 0.0 109.235 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HB1' ' A' ' 77' ' ' ALA . 0.2 OUTLIER -159.16 140.69 13.19 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.289 -0.882 . . . . 0.0 109.348 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.655 ' H ' ' CD ' ' A' ' 111' ' ' GLU . 0.3 OUTLIER -105.01 151.12 24.33 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.27 -0.894 . . . . 0.0 109.14 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -136.03 157.08 47.69 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.283 -0.886 . . . . 0.0 110.249 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.4 104.37 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.634 HG21 ' HG ' ' A' ' 120' ' ' LEU . 38.5 mm -97.83 151.43 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.184 -0.947 . . . . 0.0 109.816 -179.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -140.54 5.51 2.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.351 -0.843 . . . . 0.0 109.257 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -135.21 154.58 51.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 109.578 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -69.52 -42.37 74.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.319 -0.863 . . . . 0.0 109.739 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.1 mtmt -75.59 -4.18 38.57 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.153 -0.967 . . . . 0.0 109.294 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.623 ' HB3' HG23 ' A' ' 114' ' ' ILE . 9.9 mm-40 -86.4 0.54 53.84 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.248 -0.907 . . . . 0.0 109.618 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.634 ' HG ' HG21 ' A' ' 114' ' ' ILE . 5.1 mt -104.84 14.58 29.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.278 -0.889 . . . . 0.0 109.041 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -68.71 140.48 55.4 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.496 -0.752 . . . . 0.0 109.675 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.37 -53.02 57.18 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.213 -0.929 . . . . 0.0 109.875 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -38.78 69.24 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.173 -0.955 . . . . 0.0 109.692 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CE1' ' OE2' ' A' ' 119' ' ' GLU . 78.8 t80 -63.15 -47.71 81.55 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 122.008 0.909 . . . . 0.0 108.977 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.497 HD12 HD11 ' A' ' 79' ' ' ILE . 1.3 mm -74.4 -23.59 18.33 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.853 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -65.58 -55.52 17.2 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.341 -0.85 . . . . 0.0 109.504 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.06 -23.22 65.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.18 -0.95 . . . . 0.0 109.233 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.97 ' HG3' ' HA3' ' A' ' 133' ' ' GLY . 0.3 OUTLIER -85.14 -39.75 17.52 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.397 -0.814 . . . . 0.0 109.36 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.643 HD22 ' HD2' ' A' ' 75' ' ' LYS . 2.8 mt -69.86 -24.1 63.38 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.27 -0.894 . . . . 0.0 108.923 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -49.57 -35.71 21.45 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 121.281 -0.887 . . . . 0.0 108.678 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.594 ' HG2' ' N ' ' A' ' 132' ' ' ALA . 10.1 tttm -164.62 -80.79 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.459 -0.776 . . . . 0.0 109.645 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.594 ' N ' ' HG2' ' A' ' 131' ' ' LYS . . . -115.68 -79.61 0.59 Allowed 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.703 -0.623 . . . . 0.0 109.587 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.97 ' HA3' ' HG3' ' A' ' 128' ' ' GLU . . . 107.81 48.22 0.91 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.446 -1.461 . . . . 0.0 109.446 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.426 ' H ' ' H ' ' A' ' 135' ' ' ALA . . . 174.68 0.47 0.03 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.426 ' H ' ' H ' ' A' ' 134' ' ' GLY . . . 53.26 -120.51 1.71 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -1.138 . . . . 0.0 109.405 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' A' ' 138' ' ' ASP . 2.6 p30 -73.68 -128.39 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.24 -0.913 . . . . 0.0 109.491 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.508 ' N ' ' CG ' ' A' ' 136' ' ' ASN . 12.7 t80 65.34 -41.36 0.32 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.0 109.544 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.586 ' N ' ' O ' ' A' ' 136' ' ' ASN . 8.4 t0 -74.82 -18.28 60.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.169 -0.957 . . . . 0.0 109.487 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -142.5 92.31 2.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.272 -0.893 . . . . 0.0 109.454 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -85.43 61.06 6.62 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.271 -0.893 . . . . 0.0 109.488 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 7.6 t -92.96 5.48 51.28 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.242 -0.911 . . . . 0.0 109.52 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 117.959 -1.019 . . . . 0.0 109.47 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 3' ' ' THR . . . -79.19 156.53 28.15 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.32 -0.862 . . . . 0.0 109.488 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.567 HG21 ' OD1' ' A' ' 97' ' ' ASP . 0.2 OUTLIER 70.54 144.99 0.06 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.297 -0.877 . . . . 0.0 109.471 179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.438 ' HB3' HG23 ' A' ' 35' ' ' THR . 0.3 OUTLIER -133.63 129.34 36.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.391 -0.818 . . . . 0.0 109.452 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.594 ' HB ' HD13 ' A' ' 100' ' ' LEU . 3.3 tp -107.53 135.26 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.835 . . . . 0.0 109.692 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.538 ' O ' ' N ' ' A' ' 8' ' ' GLU . 83.8 m-20 -98.1 49.12 1.0 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.443 ' CE ' ' O ' ' A' ' 104' ' ' VAL . 0.1 OUTLIER -40.44 -24.34 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.459 -0.776 . . . . 0.0 109.804 -179.409 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.547 ' N ' ' OE1' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -47.49 -39.31 15.68 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.148 -0.97 . . . . 0.0 109.046 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.24 -57.75 3.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.329 -0.857 . . . . 0.0 109.399 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -52.34 -69.46 0.11 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.124 -0.985 . . . . 0.0 109.536 -179.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.407 ' C ' ' O ' ' A' ' 10' ' ' CYS . 19.2 ttt180 -44.3 -57.64 3.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.858 -1.151 . . . . 0.0 109.378 -179.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.6 -52.77 53.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -19.17 65.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.277 -0.889 . . . . 0.0 109.408 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.65 ' CE2' ' CE1' ' A' ' 61' ' ' PHE . 0.2 OUTLIER -73.72 -56.3 5.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.373 -0.829 . . . . 0.0 109.721 -179.497 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.734 HD22 HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -77.77 -17.88 57.04 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.332 -0.855 . . . . 0.0 109.918 -179.395 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.03 -39.27 86.98 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.125 -0.984 . . . . 0.0 109.356 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.525 HG22 ' O ' ' A' ' 14' ' ' TYR . 16.0 m -70.98 -4.57 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.182 -0.949 . . . . 0.0 109.511 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 -69.6 5.61 1.37 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.24 -0.912 . . . . 0.0 109.404 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.422 ' H ' ' C ' ' A' ' 17' ' ' VAL . 9.4 t70 -91.65 -146.68 0.21 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.215 -0.928 . . . . 0.0 109.54 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -105.98 44.25 1.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.307 -0.871 . . . . 0.0 109.446 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 69.79 55.58 9.44 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.61 8.09 17.53 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.396 -1.061 . . . . 0.0 109.568 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.2 -128.81 0.14 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.36 -0.838 . . . . 0.0 109.73 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.551 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -105.67 119.09 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.407 -0.808 . . . . 0.0 109.554 -179.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.814 HG22 ' O ' ' A' ' 42' ' ' GLY . 9.9 tt -48.26 -39.79 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.023 -1.048 . . . . 0.0 108.946 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.698 ' CD1' HG23 ' A' ' 25' ' ' ILE . 34.5 p-90 -156.24 150.68 25.67 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.872 -1.143 . . . . 0.0 110.371 178.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -116.05 152.39 17.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.445 -0.785 . . . . 0.0 109.479 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.545 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 5.9 p -129.76 135.56 48.6 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.442 -0.786 . . . . 0.0 110.035 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.435 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -124.15 119.15 28.59 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -100.34 147.79 25.41 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.634 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.781 ' OH ' HG23 ' A' ' 94' ' ' THR . 12.3 m-85 -49.49 98.97 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.552 -0.718 . . . . 0.0 110.113 -179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.71 101.54 13.24 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 63.09 -121.0 23.39 Favored Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.046 -1.622 . . . . 0.0 109.046 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.22 22.09 16.43 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.392 -1.063 . . . . 0.0 110.081 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.438 HG23 ' HB3' ' A' ' 4' ' ' LYS . 24.0 m -142.72 132.36 23.88 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.28 -0.888 . . . . 0.0 110.042 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.463 ' H ' HD12 ' A' ' 36' ' ' ILE . 4.5 mp -79.12 114.98 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.349 -0.844 . . . . 0.0 108.956 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.9 OUTLIER -135.55 151.88 75.33 Favored Pre-proline 0 N--CA 1.49 1.571 0 O-C-N 121.389 -0.819 . . . . 0.0 109.804 -179.322 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.412 ' C ' ' O ' ' A' ' 37' ' ' VAL . 90.3 Cg_exo -34.57 149.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.653 2.236 . . . . 0.0 111.744 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 28' ' ' THR . . . -136.53 -44.35 0.09 OUTLIER Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.611 ' CG ' HE22 ' A' ' 51' ' ' GLN . 0.7 OUTLIER -143.02 -178.86 6.04 Favored 'General case' 0 C--N 1.294 -1.808 0 O-C-N 121.672 -0.899 . . . . 0.0 109.157 179.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.613 ' NE2' ' CE1' ' A' ' 47' ' ' HIS . 0.0 OUTLIER -144.85 -166.97 2.54 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.441 -0.787 . . . . 0.0 109.789 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.814 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -166.82 134.45 3.28 Favored Glycine 0 N--CA 1.487 2.051 0 N-CA-C 109.654 -1.379 . . . . 0.0 109.654 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -106.14 -5.55 19.27 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -158.2 176.11 12.91 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.505 ' CE2' ' CE2' ' A' ' 48' ' ' PHE . 1.6 t80 -73.79 -44.74 55.05 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.012 -1.055 . . . . 0.0 109.55 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 45' ' ' TYR . 21.7 mm-40 -42.29 -37.89 1.65 Allowed 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.263 -0.898 . . . . 0.0 110.274 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.613 ' CE1' ' NE2' ' A' ' 41' ' ' GLN . 3.5 t-160 -60.99 -43.67 98.51 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.061 -1.024 . . . . 0.0 109.781 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.619 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.1 OUTLIER -49.47 -33.99 15.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.133 -0.979 . . . . 0.0 108.707 179.724 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.428 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.7 mt -64.36 -43.99 97.13 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.419 -0.8 . . . . 0.0 111.203 -178.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.554 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 2.6 tm0? -85.72 -13.63 47.81 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.658 -1.276 . . . . 0.0 107.951 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.611 HE22 ' CG ' ' A' ' 40' ' ' ASP . 0.1 OUTLIER -96.52 -6.56 36.75 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.583 -178.692 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.57 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 16.8 p -123.37 54.08 1.29 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.416 -0.803 . . . . 0.0 110.317 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.449 ' C ' ' H ' ' A' ' 55' ' ' ASP . 40.9 p -75.48 155.1 36.53 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.856 -1.152 . . . . 0.0 109.42 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 p30 -71.77 12.58 0.36 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.284 -0.885 . . . . 0.0 109.768 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.449 ' H ' ' C ' ' A' ' 53' ' ' THR . 13.0 t70 -97.67 -0.19 46.01 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.171 -0.955 . . . . 0.0 110.169 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.514 HG13 ' N ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.41 176.07 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 120.909 -1.119 . . . . 0.0 110.634 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.761 ' NE ' HG11 ' A' ' 86' ' ' VAL . 5.5 ptp180 -138.96 134.75 33.56 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.772 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.5 pp -168.6 172.34 8.15 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.369 -0.832 . . . . 0.0 109.172 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -105.44 152.73 22.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -0.981 . . . . 0.0 109.282 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -130.17 153.56 48.43 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.418 -0.801 . . . . 0.0 108.998 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.65 ' CE1' ' CE2' ' A' ' 14' ' ' TYR . 0.5 OUTLIER -136.78 107.76 6.7 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.395 -0.815 . . . . 0.0 109.038 -179.583 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.416 ' HB ' ' HB3' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -133.1 143.32 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 C-N-CA 119.099 -1.04 . . . . 0.0 110.393 -179.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -83.12 115.89 22.09 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -93.76 155.72 17.07 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.232 -0.917 . . . . 0.0 110.171 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.57 149.16 34.88 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.505 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 0.9 OUTLIER -109.63 6.34 23.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.369 -0.832 . . . . 0.0 109.547 -179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 150.77 135.27 2.34 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -79.69 70.56 6.21 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.211 -1.17 . . . . 0.0 109.474 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -150.47 -92.06 0.06 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.236 -0.915 . . . . 0.0 109.448 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.535 ' C ' ' H ' ' A' ' 72' ' ' LYS . 2.8 mtt -75.12 -44.15 48.77 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.138 -0.976 . . . . 0.0 109.454 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.456 ' C ' ' H ' ' A' ' 73' ' ' ARG . 1.2 m 54.82 3.9 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.271 -0.893 . . . . 0.0 109.517 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.535 ' H ' ' C ' ' A' ' 70' ' ' MET . 71.0 mttt -73.1 15.7 0.2 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.245 -0.909 . . . . 0.0 109.482 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' CB ' ' A' ' 74' ' ' SER . 30.3 ttt180 -137.62 -62.33 0.61 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.283 -0.885 . . . . 0.0 109.395 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.51 ' CB ' ' O ' ' A' ' 73' ' ' ARG . 0.5 OUTLIER 76.37 162.5 0.24 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.211 -0.931 . . . . 0.0 109.499 179.879 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.505 ' HE2' ' HA ' ' A' ' 66' ' ' THR . 8.2 mttm -105.02 150.55 24.86 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.35 -0.844 . . . . 0.0 109.673 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.553 ' O ' ' N ' ' A' ' 109' ' ' ALA . 89.1 m-85 -133.36 117.81 17.73 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.44 -0.788 . . . . 0.0 109.119 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.71 165.14 28.49 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.973 -1.079 . . . . 0.0 111.456 -178.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 79' ' ' ILE . 11.7 tp -108.89 145.72 34.91 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 179.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 114' ' ' ILE . 19.6 mt -131.33 141.44 45.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 120.85 -1.156 . . . . 0.0 108.846 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.0 m -112.62 124.83 53.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.063 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.564 ' CZ2' ' O ' ' A' ' 52' ' ' CYS . 60.8 t-105 -96.83 113.34 24.88 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.989 -1.069 . . . . 0.0 109.832 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mm -111.21 93.25 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -74.58 162.79 54.19 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 -179.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -110.46 66.97 0.63 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.627 -0.926 . . . . 0.0 109.689 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.448 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.2 t0 -169.41 -46.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.218 -0.926 . . . . 0.0 109.552 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.761 HG11 ' NE ' ' A' ' 57' ' ' ARG . 7.4 p -41.62 157.49 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.291 -0.881 . . . . 0.0 109.951 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.459 ' N ' HG22 ' A' ' 86' ' ' VAL . 30.1 p -61.09 173.55 0.8 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.414 -0.804 . . . . 0.0 109.971 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.38 -21.49 56.49 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 110.145 -1.182 . . . . 0.0 110.145 -179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.63 -69.77 0.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.122 -1.222 . . . . 0.0 110.017 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.586 ' OE1' ' CD2' ' A' ' 31' ' ' TYR . 84.1 mm-40 -49.14 -22.88 1.06 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.249 -0.907 . . . . 0.0 109.81 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.438 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 1.7 ttp180 -55.85 -44.13 77.71 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.808 -1.183 . . . . 0.0 109.436 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -74.83 -35.66 62.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.234 -0.916 . . . . 0.0 109.894 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.408 ' O ' ' C ' ' A' ' 94' ' ' THR . 10.6 mmmt -74.71 -48.44 25.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.229 -0.919 . . . . 0.0 109.358 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.781 HG23 ' OH ' ' A' ' 31' ' ' TYR . 35.3 m -45.2 -59.5 2.6 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.348 -0.845 . . . . 0.0 109.422 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -44.73 -59.99 4.03 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.859 -1.297 . . . . 0.0 109.859 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 p -63.21 -51.45 66.24 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.986 -1.302 . . . . 0.0 110.521 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.567 ' OD1' HG21 ' A' ' 3' ' ' THR . 7.4 m-20 -58.45 -45.87 87.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.016 -1.052 . . . . 0.0 110.631 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -51.22 -31.16 19.61 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 120.847 -1.158 . . . . 0.0 108.24 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.44 -41.18 96.79 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.594 HD13 ' HB ' ' A' ' 5' ' ' ILE . 95.0 mt -48.12 -57.97 5.13 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.536 ' C ' ' H ' ' A' ' 103' ' ' GLU . 4.5 t -56.47 -50.72 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 tttm -65.02 7.0 0.19 Allowed 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.536 ' H ' ' C ' ' A' ' 101' ' ' VAL . 3.0 tt0 -99.77 -44.55 6.05 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -0.792 . . . . 0.0 109.368 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.781 HG12 ' O ' ' A' ' 104' ' ' VAL . 53.4 t -123.02 62.93 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.439 -0.788 . . . . 0.0 109.863 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.622 HG13 ' O ' ' A' ' 105' ' ' VAL . 4.1 p -132.63 115.22 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 120.999 -1.063 . . . . 0.0 110.361 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.611 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.0 OUTLIER -125.2 -36.54 2.5 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.181 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.734 HD22 HD22 ' A' ' 15' ' ' ASN . 8.3 m-20 -60.84 32.05 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.928 -0.482 . . . . 0.0 110.245 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.611 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.7 OUTLIER -139.43 139.19 37.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.023 -1.048 . . . . 0.0 109.085 179.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.553 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -78.84 -35.58 43.78 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.172 -0.955 . . . . 0.0 109.41 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -162.65 157.72 22.24 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.27 -0.894 . . . . 0.0 109.456 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.73 156.45 17.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.209 -0.932 . . . . 0.0 108.922 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -139.14 154.92 48.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.136 -0.978 . . . . 0.0 110.104 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.923 ' O ' HD13 ' A' ' 114' ' ' ILE . 6.7 p -119.5 157.76 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.923 HD13 ' O ' ' A' ' 113' ' ' VAL . 2.4 mm -136.33 148.23 27.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.183 -0.948 . . . . 0.0 109.826 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.53 -3.92 2.97 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.434 ' O ' ' N ' ' A' ' 119' ' ' GLU . 0.1 OUTLIER -157.76 133.61 9.25 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.298 -0.876 . . . . 0.0 109.51 179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.415 ' C ' ' O ' ' A' ' 116' ' ' ASP . 25.4 ttp180 -44.25 -25.37 0.23 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.254 -0.903 . . . . 0.0 109.625 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 116' ' ' ASP . 16.3 tttt -75.82 -18.56 59.43 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.174 -0.954 . . . . 0.0 109.359 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.608 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 59.4 mt-10 -86.28 -3.38 58.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.335 -0.853 . . . . 0.0 109.467 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.613 HD13 ' CE1' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -105.27 31.41 4.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.176 -0.953 . . . . 0.0 108.866 -179.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -83.04 155.1 24.09 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.509 -0.744 . . . . 0.0 109.783 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.15 -50.77 60.05 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.112 -0.993 . . . . 0.0 109.44 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.3 -15.3 9.77 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.891 . . . . 0.0 109.936 -179.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.608 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 15.0 t80 -84.8 -49.28 8.57 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.343 -0.848 . . . . 0.0 109.184 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.542 ' CG2' HD12 ' A' ' 129' ' ' LEU . 3.0 mt -77.99 -11.88 13.56 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.802 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.14 -55.86 5.07 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.346 -0.846 . . . . 0.0 108.87 179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -17.54 64.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.264 -0.897 . . . . 0.0 109.461 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.439 ' CA ' ' OE1' ' A' ' 128' ' ' GLU . 0.1 OUTLIER -84.74 -40.14 17.64 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.336 -0.852 . . . . 0.0 109.364 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.542 HD12 ' CG2' ' A' ' 125' ' ' ILE . 2.5 mt -79.24 -7.97 58.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.29 -0.881 . . . . 0.0 109.724 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.38 -11.4 46.3 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.05 -1.031 . . . . 0.0 108.942 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.705 ' O ' ' HB3' ' A' ' 132' ' ' ALA . 11.4 mttt -88.77 -64.11 1.19 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.403 -0.811 . . . . 0.0 109.404 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . 0.705 ' HB3' ' O ' ' A' ' 131' ' ' LYS . . . 76.96 -14.77 0.8 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.405 ' C ' ' O ' ' A' ' 132' ' ' ALA . . . 43.23 39.33 4.03 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.536 -1.426 . . . . 0.0 109.536 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 74.67 100.06 0.1 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.42 -52.45 18.47 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.325 -1.103 . . . . 0.0 109.511 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.59 ' H ' HD22 ' A' ' 136' ' ' ASN . 0.1 OUTLIER -142.78 13.85 1.91 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.242 -0.911 . . . . 0.0 109.494 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.44 ' O ' ' CD2' ' A' ' 137' ' ' TYR . 50.6 t80 -96.59 39.01 1.17 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.303 -0.873 . . . . 0.0 109.521 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -138.77 3.82 2.29 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.167 -0.958 . . . . 0.0 109.433 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.502 ' O ' ' NE2' ' A' ' 140' ' ' GLN . . . -100.73 -65.49 0.97 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.317 -0.864 . . . . 0.0 109.404 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 139' ' ' ALA . 62.4 mm-40 -139.91 -123.34 0.11 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.199 -0.938 . . . . 0.0 109.425 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.66 86.03 0.43 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.261 -0.9 . . . . 0.0 109.491 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 118.005 -0.998 . . . . 0.0 109.462 179.987 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ptt? . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.75 -5.65 51.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.24 -0.912 . . . . 0.0 109.459 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -96.09 134.69 38.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.229 -0.919 . . . . 0.0 109.477 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB3' HG23 ' A' ' 35' ' ' THR . 4.7 mmtp -136.73 118.61 15.19 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.206 -0.934 . . . . 0.0 109.427 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.763 ' CD1' HG22 ' A' ' 101' ' ' VAL . 0.9 OUTLIER -107.07 142.29 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.304 -0.873 . . . . 0.0 109.895 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.442 ' O ' ' C ' ' A' ' 7' ' ' LYS . 9.7 m-20 -90.25 44.5 1.2 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.301 -0.874 . . . . 0.0 108.974 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -38.68 -31.13 0.05 Allowed 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.613 -0.679 . . . . 0.0 110.336 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' A' ' 6' ' ' ASP . 31.4 mt-10 -55.06 -51.22 67.03 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.22 -0.925 . . . . 0.0 110.307 -179.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.96 -69.38 0.18 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.131 -0.981 . . . . 0.0 110.368 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -44.74 -57.89 3.42 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.218 -0.926 . . . . 0.0 110.465 -179.168 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.577 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 19.3 ttt180 -44.99 -58.54 3.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.93 -1.106 . . . . 0.0 110.266 -178.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.06 -46.42 82.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.147 -0.971 . . . . 0.0 110.218 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.402 ' HB3' HG21 ' A' ' 27' ' ' VAL . . . -77.39 -10.54 59.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.046 -1.034 . . . . 0.0 110.348 -179.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.509 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.5 m-85 -81.31 -54.2 5.68 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.762 HD22 HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -75.99 -14.41 60.23 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.188 -0.945 . . . . 0.0 109.461 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' A' ' 18' ' ' ARG . 5.2 tt -73.48 -51.48 16.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.379 -0.825 . . . . 0.0 109.474 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.589 HG22 ' O ' ' A' ' 17' ' ' VAL . 3.3 p -55.37 -4.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.206 -0.934 . . . . 0.0 109.524 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -82.57 -13.93 55.72 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.303 -0.873 . . . . 0.0 109.453 -179.819 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.487 ' O ' ' O ' ' A' ' 18' ' ' ARG . 4.3 p-10 -58.23 -151.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.33 -0.856 . . . . 0.0 109.649 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.92 43.98 1.1 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.232 -0.917 . . . . 0.0 109.314 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.41 56.97 5.81 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.661 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 2.8 t -76.41 -42.18 45.12 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.22 -1.165 . . . . 0.0 109.384 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.661 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 166.96 -168.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.269 -0.894 . . . . 0.0 109.463 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.796 ' O ' HG12 ' A' ' 24' ' ' VAL . 75.7 t 47.24 52.28 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.162 -0.961 . . . . 0.0 109.365 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.906 HG23 ' CD1' ' A' ' 26' ' ' TRP . 12.8 tt -46.26 -29.78 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 120.824 -1.172 . . . . 0.0 108.575 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.906 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.2 p-90 -156.17 150.94 26.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.879 -1.138 . . . . 0.0 110.076 177.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -113.24 144.84 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.535 -0.728 . . . . 0.0 109.797 -179.785 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 59' ' ' PHE . 18.4 p -138.11 132.73 32.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.42 -0.8 . . . . 0.0 109.77 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -120.24 145.15 47.31 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.46 ' O ' ' N ' ' A' ' 32' ' ' ASP . 24.7 ptt180 -119.49 141.29 49.31 Favored 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 119.765 -0.774 . . . . 0.0 109.95 -178.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.45 ' CD1' ' NE2' ' A' ' 90' ' ' GLN . 0.6 OUTLIER -41.28 98.44 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.718 -0.614 . . . . 0.0 109.783 -179.422 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -91.47 101.99 14.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.884 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 54.11 -116.51 6.31 Favored Glycine 0 N--CA 1.487 2.087 0 N-CA-C 108.893 -1.683 . . . . 0.0 108.893 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.52 25.3 11.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.391 -1.064 . . . . 0.0 110.211 -179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.409 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.7 m -146.31 133.91 20.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.193 -0.942 . . . . 0.0 109.816 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 4.1 mp -81.72 111.98 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.031 -1.043 . . . . 0.0 108.73 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.45 152.49 76.6 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.347 -0.846 . . . . 0.0 109.977 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -39.16 140.44 0.48 Allowed 'Trans proline' 0 C--N 1.311 -1.409 0 C-N-CA 122.659 2.239 . . . . 0.0 112.249 179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.18 -33.49 0.36 Allowed Glycine 0 N--CA 1.49 2.243 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.535 ' CB ' HE22 ' A' ' 51' ' ' GLN . 0.2 OUTLIER -143.12 -177.93 5.59 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.619 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.3 OUTLIER -138.44 -176.94 4.64 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-O 121.821 0.82 . . . . 0.0 110.387 -179.826 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.633 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -119.66 83.71 0.36 Allowed Glycine 0 N--CA 1.479 1.556 0 N-CA-C 108.415 -1.874 . . . . 0.0 108.415 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.607 ' O ' ' CB ' ' A' ' 44' ' ' ASP . . . -104.71 56.38 0.7 Allowed 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.643 -0.916 . . . . 0.0 108.53 179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.607 ' CB ' ' O ' ' A' ' 43' ' ' ALA . 33.5 t0 120.21 140.84 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 -179.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -56.86 -47.36 80.6 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.067 -1.021 . . . . 0.0 108.462 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -53.27 -34.87 59.05 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.345 -0.847 . . . . 0.0 109.416 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.469 ' ND1' ' NE2' ' A' ' 41' ' ' GLN . 0.4 OUTLIER -53.21 -28.95 29.56 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.092 -1.005 . . . . 0.0 108.896 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.597 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.24 -34.98 75.66 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.43 HG12 ' CE2' ' A' ' 48' ' ' PHE . 4.5 mt -76.29 -13.97 14.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.222 -0.924 . . . . 0.0 109.553 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.525 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 26.4 tp60 -87.67 -50.41 6.51 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.105 -0.997 . . . . 0.0 109.411 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.535 HE22 ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -108.07 55.97 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.64 -0.662 . . . . 0.0 111.145 -178.183 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.1 t -162.32 62.66 0.22 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.082 -1.011 . . . . 0.0 109.184 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.583 ' O ' ' N ' ' A' ' 55' ' ' ASP . 2.5 p -87.54 154.68 20.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.404 -0.81 . . . . 0.0 109.916 -179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -46.14 -11.83 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.856 . . . . 0.0 109.652 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.583 ' N ' ' O ' ' A' ' 53' ' ' THR . 1.9 t70 -93.27 35.37 1.09 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.202 -0.936 . . . . 0.0 109.403 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.581 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 53.3 t -145.4 145.3 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.282 -0.886 . . . . 0.0 109.45 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.654 HH11 ' CG ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -131.51 122.98 27.08 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.48 -0.762 . . . . 0.0 109.68 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.606 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.1 pp -172.84 -170.93 0.71 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.934 -1.104 . . . . 0.0 110.718 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.623 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -118.32 153.61 33.69 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.213 -0.929 . . . . 0.0 109.145 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -136.31 156.35 48.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.791 -1.193 . . . . 0.0 109.309 179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -149.56 103.35 3.26 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.16 -0.962 . . . . 0.0 109.375 -179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -118.37 154.37 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.241 -0.912 . . . . 0.0 109.602 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.582 ' NH2' ' O ' ' A' ' 17' ' ' VAL . 14.4 ttp180 -84.61 130.73 34.69 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 43.2 m-85 -118.26 157.1 27.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.439 -0.788 . . . . 0.0 109.83 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.58 ' O ' ' NZ ' ' A' ' 75' ' ' LYS . 8.7 t -97.0 140.96 30.75 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.314 -0.866 . . . . 0.0 109.044 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.58 ' O ' ' N ' ' A' ' 68' ' ' ASP . 0.2 OUTLIER -109.64 110.84 22.01 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.4 -0.813 . . . . 0.0 109.614 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.436 ' O ' ' CG ' ' A' ' 68' ' ' ASP . . . 57.28 -78.92 0.01 OUTLIER Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.58 ' N ' ' O ' ' A' ' 66' ' ' THR . 1.0 OUTLIER 176.72 -37.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.262 -1.14 . . . . 0.0 109.333 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.61 ' CB ' ' HB2' ' A' ' 73' ' ' ARG . . . 62.45 -174.9 0.14 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.273 -0.892 . . . . 0.0 109.486 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.79 ' SD ' ' O ' ' A' ' 70' ' ' MET . 1.8 tmm? -88.8 -28.05 20.7 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.312 -0.867 . . . . 0.0 109.427 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.427 ' OG ' ' CE ' ' A' ' 70' ' ' MET . 19.9 m -135.23 -59.29 0.78 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.303 -0.873 . . . . 0.0 109.553 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.483 ' O ' ' CB ' ' A' ' 73' ' ' ARG . 16.4 mmtp -138.89 -93.58 0.18 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.229 -0.919 . . . . 0.0 109.528 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.61 ' HB2' ' CB ' ' A' ' 69' ' ' ALA . 0.1 OUTLIER 74.15 12.88 4.08 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.303 -0.873 . . . . 0.0 109.421 -179.911 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.419 ' C ' ' O ' ' A' ' 73' ' ' ARG . 25.0 p -42.56 151.2 0.12 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.271 -0.893 . . . . 0.0 109.459 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.58 ' NZ ' ' O ' ' A' ' 65' ' ' THR . 4.2 pttm -107.32 130.93 54.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.364 -0.835 . . . . 0.0 109.215 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.518 ' O ' ' N ' ' A' ' 109' ' ' ALA . 98.9 m-85 -103.82 129.3 51.25 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 110.275 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.57 161.95 37.82 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.126 -0.984 . . . . 0.0 111.241 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.8 157.44 25.56 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 6.9 mt -137.55 143.38 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 120.843 -1.161 . . . . 0.0 109.309 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.596 ' N ' ' O ' ' A' ' 112' ' ' PHE . 0.2 OUTLIER -100.82 114.83 28.99 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.162 -0.961 . . . . 0.0 109.03 179.636 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.597 ' CH2' ' O ' ' A' ' 115' ' ' SER . 73.5 t-105 -92.81 110.49 21.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.142 -0.973 . . . . 0.0 109.785 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.463 ' O ' ' OG ' ' A' ' 115' ' ' SER . 8.1 mm -114.88 92.5 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.03 161.09 0.05 OUTLIER Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -88.36 -20.27 25.55 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -1.109 . . . . 0.0 109.457 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.49 41.46 1.23 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 109.505 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.514 HG12 ' N ' ' A' ' 87' ' ' SER . 52.0 t -96.83 161.98 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.228 -0.92 . . . . 0.0 109.732 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.514 ' N ' HG12 ' A' ' 86' ' ' VAL . 7.9 t -95.32 -162.47 0.95 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.253 -0.904 . . . . 0.0 109.42 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.06 -18.12 63.69 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.5 mt -46.69 -60.86 2.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.912 -1.346 . . . . 0.0 109.79 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.45 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 22.3 mm-40 -56.8 -30.76 64.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.006 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -50.93 -62.32 1.68 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.924 -1.11 . . . . 0.0 109.916 -179.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.99 -44.04 15.71 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.161 -0.962 . . . . 0.0 110.014 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.401 ' O ' ' OH ' ' A' ' 31' ' ' TYR . 21.3 mtpt -58.43 -58.93 6.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.207 -0.933 . . . . 0.0 110.007 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.442 ' OG1' ' CD ' ' A' ' 90' ' ' GLN . 2.1 m -57.19 -40.82 78.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.111 -0.993 . . . . 0.0 109.487 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -43.72 -59.61 3.67 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 110.164 -1.175 . . . . 0.0 110.164 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 24.9 p -63.8 -42.88 97.63 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.072 -1.252 . . . . 0.0 110.845 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.0 -44.18 90.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.852 -1.155 . . . . 0.0 111.192 -178.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -26.56 45.88 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.683 -1.261 . . . . 0.0 108.899 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -50.78 48.67 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.431 -0.793 . . . . 0.0 109.275 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.577 ' N ' HD12 ' A' ' 100' ' ' LEU . 8.5 mp -57.3 -59.49 5.05 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.763 HG22 ' CD1' ' A' ' 5' ' ' ILE . 21.8 t -44.46 -69.18 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.344 -0.847 . . . . 0.0 109.409 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.9 ttpp -48.61 -47.79 39.74 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.466 -0.771 . . . . 0.0 110.046 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -60.86 -31.55 71.0 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 111.013 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.7 p -106.28 13.71 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.096 -1.003 . . . . 0.0 110.747 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.493 ' CG1' ' O ' ' A' ' 105' ' ' VAL . 1.0 OUTLIER -108.39 124.43 64.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.102 -0.999 . . . . 0.0 109.829 179.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.648 ' C ' ' H ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -126.51 -30.21 2.86 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 179.572 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.762 HD22 HD22 ' A' ' 15' ' ' ASN . 2.2 t-20 -62.39 29.27 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.537 -0.727 . . . . 0.0 109.93 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.648 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -141.95 160.85 39.37 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.153 -0.967 . . . . 0.0 109.238 179.502 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -95.66 -37.97 10.58 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.381 -0.824 . . . . 0.0 109.609 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HB2' ' HZ3' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -158.29 159.83 36.38 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.181 -0.949 . . . . 0.0 109.438 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.75 160.48 14.94 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.268 -0.895 . . . . 0.0 109.172 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.596 ' O ' ' N ' ' A' ' 80' ' ' THR . 12.9 m-85 -138.54 149.71 45.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.286 -0.884 . . . . 0.0 109.875 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.403 ' HA ' ' HG1' ' A' ' 80' ' ' THR . 58.6 t -114.67 118.73 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.525 -0.734 . . . . 0.0 109.036 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.497 HG23 ' OE2' ' A' ' 119' ' ' GLU . 7.2 mt -138.55 158.62 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.201 -0.937 . . . . 0.0 110.289 -179.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.597 ' O ' ' CH2' ' A' ' 81' ' ' TRP . 11.2 t -134.1 -46.15 0.78 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.95 155.57 23.95 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.59 -0.694 . . . . 0.0 109.619 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -79.62 -17.82 52.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.107 -0.995 . . . . 0.0 109.841 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 60.4 tttt -73.51 -33.47 64.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.096 -1.003 . . . . 0.0 109.832 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.588 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 0.3 OUTLIER -86.34 5.02 36.69 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.062 -1.024 . . . . 0.0 109.853 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.471 HD22 ' CE1' ' A' ' 48' ' ' PHE . 4.0 tt -104.26 0.45 29.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.166 -0.959 . . . . 0.0 109.188 179.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -49.5 139.36 12.22 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.428 -0.795 . . . . 0.0 109.798 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.542 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.1 OUTLIER -52.08 -53.81 37.89 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.237 -0.914 . . . . 0.0 109.878 -179.871 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . 0.401 ' OD1' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -55.01 -48.81 72.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.096 -1.002 . . . . 0.0 109.825 -179.265 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 65.9 t80 -48.48 -42.69 33.53 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 122.203 1.001 . . . . 0.0 109.073 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.2 mm -76.11 -24.28 16.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.908 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 4.7 ttp180 -65.1 -55.71 17.18 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.238 -0.914 . . . . 0.0 109.107 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.0 t -62.52 -21.4 65.5 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.373 -0.829 . . . . 0.0 109.361 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -76.55 -41.74 45.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.436 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.579 ' C ' ' H ' ' A' ' 131' ' ' LYS . 16.3 mt -69.14 -38.7 78.96 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.154 -0.966 . . . . 0.0 108.56 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -54.33 -4.78 0.06 Allowed 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.153 -0.967 . . . . 0.0 108.567 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.579 ' H ' ' C ' ' A' ' 129' ' ' LEU . 6.9 tttp 60.9 102.25 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 CA-C-O 121.725 0.774 . . . . 0.0 109.421 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -149.51 41.62 0.88 Allowed 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 119.722 -0.791 . . . . 0.0 109.57 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.46 -36.94 8.39 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -100.53 121.99 7.43 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -147.75 67.52 1.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -1.121 . . . . 0.0 109.45 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.495 ' N ' ' OD1' ' A' ' 136' ' ' ASN . 0.0 OUTLIER -75.92 -49.0 19.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.297 -0.877 . . . . 0.0 109.461 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.497 ' CG ' ' O ' ' A' ' 137' ' ' TYR . 66.5 t80 52.07 23.72 2.38 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.332 -0.855 . . . . 0.0 109.474 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.522 ' O ' ' HB2' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -167.54 -61.33 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.287 -0.883 . . . . 0.0 109.509 179.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.522 ' HB2' ' O ' ' A' ' 138' ' ' ASP . . . 174.28 122.66 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.278 -0.889 . . . . 0.0 109.48 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.452 ' O ' ' O ' ' A' ' 141' ' ' SER . 0.1 OUTLIER -84.39 118.84 24.5 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.254 -0.904 . . . . 0.0 109.521 179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' A' ' 142' ' ' GLU . 1.2 t 49.91 179.57 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.258 -0.901 . . . . 0.0 109.469 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.514 ' N ' ' OG ' ' A' ' 141' ' ' SER . 4.4 tt0 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.994 -1.003 . . . . 0.0 109.507 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.516 ' C ' ' H ' ' A' ' 3' ' ' THR . 9.1 mtm . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 52.85 6.01 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.286 -0.884 . . . . 0.0 109.452 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.516 ' H ' ' C ' ' A' ' 1' ' ' MET . 0.3 OUTLIER -90.37 126.75 35.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.27 -0.894 . . . . 0.0 109.458 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.451 ' CB ' HG23 ' A' ' 35' ' ' THR . 3.7 mtpt -130.18 135.95 48.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.394 -0.816 . . . . 0.0 109.48 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.522 ' HB ' HD13 ' A' ' 100' ' ' LEU . 3.9 tp -118.46 130.28 73.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.47 -0.769 . . . . 0.0 109.335 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.504 ' O ' ' N ' ' A' ' 8' ' ' GLU . 5.6 m-20 -91.73 39.68 1.02 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.118 -0.989 . . . . 0.0 109.051 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.694 ' NZ ' ' H ' ' A' ' 104' ' ' VAL . 3.5 mttt -42.43 -23.34 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.21 -0.931 . . . . 0.0 109.813 -179.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.52 ' H ' ' CD ' ' A' ' 8' ' ' GLU . 39.3 mp0 -50.11 -35.46 25.69 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.093 -1.005 . . . . 0.0 108.364 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.42 -46.02 13.01 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.57 ' O ' ' N ' ' A' ' 14' ' ' TYR . 13.0 t -60.67 -66.17 0.57 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.242 -0.911 . . . . 0.0 109.489 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.484 ' O ' ' OD1' ' A' ' 15' ' ' ASN . 32.0 ttp180 -44.19 -56.24 4.24 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.756 -1.215 . . . . 0.0 109.882 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.13 -28.07 67.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.01 -1.056 . . . . 0.0 109.762 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.458 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -88.5 -58.22 2.63 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.073 -1.017 . . . . 0.0 109.605 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.661 ' CD1' ' CD1' ' A' ' 61' ' ' PHE . 5.9 t80 -45.16 -51.18 10.76 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.301 -179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.536 ' N ' ' ND2' ' A' ' 15' ' ' ASN . 0.3 OUTLIER -71.22 -45.04 64.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.023 -1.048 . . . . 0.0 110.248 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.522 ' C ' ' H ' ' A' ' 18' ' ' ARG . 20.6 tp -41.54 -48.64 3.98 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.076 -1.015 . . . . 0.0 110.063 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 14' ' ' TYR . 1.2 m -53.85 -4.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.062 -1.024 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.522 ' H ' ' C ' ' A' ' 16' ' ' LEU . 6.8 ttm180 -76.63 -17.13 59.34 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.149 -0.97 . . . . 0.0 109.285 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.486 ' O ' ' O ' ' A' ' 18' ' ' ARG . 22.2 t0 -58.0 -151.61 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.255 -0.903 . . . . 0.0 109.627 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.441 ' H ' ' CG ' ' A' ' 19' ' ' ASP . 12.9 t70 -102.47 59.41 0.81 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.219 -0.926 . . . . 0.0 109.471 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 67.44 50.86 40.99 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.454 -1.458 . . . . 0.0 109.454 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.749 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.6 OUTLIER -72.54 -39.76 67.25 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.274 -1.133 . . . . 0.0 109.592 -179.805 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.749 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 158.15 -164.4 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.591 -0.693 . . . . 0.0 109.559 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.721 HG22 ' O ' ' A' ' 24' ' ' VAL . 4.6 p 35.39 57.82 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.676 -0.64 . . . . 0.0 110.458 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.813 HG22 ' O ' ' A' ' 42' ' ' GLY . 6.9 tt -42.92 -41.63 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.173 -0.954 . . . . 0.0 109.267 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.663 ' CD1' HG23 ' A' ' 25' ' ' ILE . 43.2 p-90 -149.25 166.78 27.89 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 120.992 -1.067 . . . . 0.0 110.261 178.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.453 HG13 ' CG2' ' A' ' 24' ' ' VAL . 18.3 m -137.68 141.81 38.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.274 -0.891 . . . . 0.0 109.329 179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.596 HG23 ' CE3' ' A' ' 26' ' ' TRP . 66.5 p -129.17 140.19 51.61 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 109.877 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.99 125.27 44.93 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 178.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -100.08 148.39 24.61 Favored 'General case' 0 C--N 1.296 -1.722 0 C-N-CA 119.422 -0.911 . . . . 0.0 109.334 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.925 ' OH ' HG23 ' A' ' 94' ' ' THR . 23.0 m-85 -57.87 98.7 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 O-C-N 121.558 -0.714 . . . . 0.0 109.779 -179.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.61 102.07 13.47 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 74.28 -126.14 9.18 Favored Glycine 0 N--CA 1.488 2.107 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.95 17.9 21.26 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.41 -1.053 . . . . 0.0 110.041 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.451 HG23 ' CB ' ' A' ' 4' ' ' LYS . 1.8 m -138.23 136.4 36.52 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.244 -0.91 . . . . 0.0 110.042 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.521 ' CD1' ' OD1' ' A' ' 97' ' ' ASP . 4.3 mp -79.78 115.36 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.38 150.83 73.56 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.231 -0.918 . . . . 0.0 109.937 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -34.56 152.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.376 0 C-N-CA 122.89 2.393 . . . . 0.0 112.324 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -134.29 -53.25 0.07 OUTLIER Glycine 0 N--CA 1.489 2.207 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.582 ' OD1' ' N ' ' A' ' 41' ' ' GLN . 14.1 t70 -143.28 179.53 7.03 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.713 -0.875 . . . . 0.0 108.976 179.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.589 ' CD ' ' H ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -140.98 -165.98 2.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 110.057 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.813 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -164.06 131.65 2.5 Favored Glycine 0 N--CA 1.486 1.969 0 N-CA-C 109.864 -1.295 . . . . 0.0 109.864 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -104.83 -5.06 21.51 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 44' ' ' ASP . 0.5 OUTLIER -148.3 164.84 32.81 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.56 ' C ' ' CD1' ' A' ' 45' ' ' TYR . 0.0 OUTLIER -78.48 -11.4 59.95 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.033 -1.042 . . . . 0.0 109.585 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -73.54 -31.23 63.55 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.057 -1.027 . . . . 0.0 109.759 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.448 ' O ' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -69.47 -51.84 32.3 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.978 -1.076 . . . . 0.0 109.751 -179.666 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.687 ' CE1' HD22 ' A' ' 120' ' ' LEU . 0.0 OUTLIER -43.25 -36.75 1.9 Allowed 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 108.409 -0.959 . . . . 0.0 108.409 179.548 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.425 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.1 mm -63.65 -41.31 92.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.339 -0.85 . . . . 0.0 110.455 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.543 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 1.6 tm0? -87.06 -15.74 37.67 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 178.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.489 ' OE1' ' OD2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER -99.25 61.47 1.22 Allowed 'General case' 0 C--N 1.3 -1.579 0 CA-C-O 122.261 1.029 . . . . 0.0 109.925 -179.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 14.3 p -179.86 56.63 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.971 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.27 179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.555 ' O ' ' NE1' ' A' ' 81' ' ' TRP . 3.1 p -77.87 156.01 30.63 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.058 -1.026 . . . . 0.0 110.025 -179.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.13 12.35 0.57 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.397 -0.815 . . . . 0.0 109.847 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 53' ' ' THR . 20.9 m-20 -97.89 1.21 47.85 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.199 -0.938 . . . . 0.0 109.74 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.567 HG13 ' N ' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -148.34 -179.65 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.043 -1.036 . . . . 0.0 110.293 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.802 ' CZ ' HG11 ' A' ' 86' ' ' VAL . 5.2 ptp180 -140.17 138.64 35.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.32 -0.862 . . . . 0.0 110.024 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.746 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.7 pp -172.22 169.09 5.54 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.418 -0.802 . . . . 0.0 109.409 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.529 ' O ' HG22 ' A' ' 28' ' ' THR . 3.8 m-85 -101.02 153.02 19.9 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.028 -1.045 . . . . 0.0 109.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.737 ' HB3' ' HB ' ' A' ' 79' ' ' ILE . . . -123.94 152.31 42.61 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.302 -0.874 . . . . 0.0 109.045 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.661 ' CD1' ' CD1' ' A' ' 14' ' ' TYR . 0.2 OUTLIER -140.47 96.34 3.02 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.413 -0.805 . . . . 0.0 109.087 -179.286 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.5 ' O ' ' CE2' ' A' ' 64' ' ' PHE . 0.2 OUTLIER -133.99 129.87 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 120.735 -1.228 . . . . 0.0 109.869 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.653 ' HE ' ' CB ' ' A' ' 74' ' ' SER . 3.3 ptm180 -68.16 142.86 55.6 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.932 -0.707 . . . . 0.0 109.175 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.5 ' CE2' ' O ' ' A' ' 62' ' ' VAL . 97.9 m-85 -118.79 155.92 30.3 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.378 -0.826 . . . . 0.0 109.796 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 m -81.75 131.43 35.26 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.157 -0.965 . . . . 0.0 109.037 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.88 78.62 1.14 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.353 -0.842 . . . . 0.0 109.484 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 92.29 94.5 1.4 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -48.8 90.69 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -1.132 . . . . 0.0 109.492 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.558 ' O ' ' N ' ' A' ' 71' ' ' SER . . . -138.02 146.28 42.88 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.3 -0.875 . . . . 0.0 109.46 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 32.1 mtt -65.89 43.1 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.255 -0.903 . . . . 0.0 109.473 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.558 ' N ' ' O ' ' A' ' 69' ' ' ALA . 0.6 OUTLIER -102.49 -11.18 18.74 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.256 -0.902 . . . . 0.0 109.396 179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' A' ' 71' ' ' SER . 27.6 mttt 43.21 53.0 5.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.239 -0.913 . . . . 0.0 109.493 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.489 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.6 tpp180 -107.21 -50.06 3.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.352 -0.843 . . . . 0.0 109.513 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.653 ' CB ' ' HE ' ' A' ' 63' ' ' ARG . 21.0 p 58.76 148.55 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.366 -0.834 . . . . 0.0 109.669 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.688 ' NZ ' ' HB3' ' A' ' 109' ' ' ALA . 3.7 ttpt -104.59 170.2 8.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.443 -0.786 . . . . 0.0 109.08 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 109' ' ' ALA . 79.1 m-85 -134.06 126.78 30.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.126 -0.984 . . . . 0.0 111.289 -178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.508 ' HB2' ' NZ ' ' A' ' 75' ' ' LYS . . . -144.79 166.6 24.79 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.518 -0.739 . . . . 0.0 110.439 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.549 HD12 ' CE2' ' A' ' 61' ' ' PHE . 2.1 tt -113.85 151.43 32.14 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.737 ' HB ' ' HB3' ' A' ' 60' ' ' ALA . 7.6 mt -128.22 131.93 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 120.949 -1.094 . . . . 0.0 109.563 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 29.5 m -100.98 124.61 46.96 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.348 -0.845 . . . . 0.0 109.831 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.555 ' NE1' ' O ' ' A' ' 53' ' ' THR . 58.0 t-105 -102.45 111.96 24.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.175 -0.953 . . . . 0.0 109.831 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mm -109.86 93.35 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.26 153.95 48.03 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -104.63 56.26 0.71 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.63 -0.923 . . . . 0.0 109.612 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.435 ' O ' ' C ' ' A' ' 86' ' ' VAL . 7.9 t70 -158.59 -39.02 0.06 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.217 -0.927 . . . . 0.0 109.528 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.802 HG11 ' CZ ' ' A' ' 57' ' ' ARG . 12.6 p -40.87 156.97 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.981 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.414 ' N ' HG22 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -66.95 -176.1 0.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.312 -0.868 . . . . 0.0 109.54 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.459 ' O ' ' CB ' ' A' ' 91' ' ' ARG . . . -84.35 -22.76 53.46 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 110.17 -1.172 . . . . 0.0 110.17 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 mp -46.68 -70.03 0.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.153 -1.204 . . . . 0.0 110.074 -179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.433 ' NE2' ' CD1' ' A' ' 31' ' ' TYR . 17.3 mt-30 -48.06 -21.71 0.5 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.224 -0.922 . . . . 0.0 109.82 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.459 ' CB ' ' O ' ' A' ' 88' ' ' GLY . 5.7 ttt180 -58.66 -45.26 89.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.966 -1.084 . . . . 0.0 109.578 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.48 -37.4 56.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.247 -0.908 . . . . 0.0 109.793 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 94' ' ' THR . 4.4 mttm -73.71 -52.94 11.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.154 -0.966 . . . . 0.0 109.539 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.925 HG23 ' OH ' ' A' ' 31' ' ' TYR . 59.6 m -45.34 -56.02 5.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.26 -0.9 . . . . 0.0 109.442 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -44.38 -60.2 3.76 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -63.79 -50.73 67.83 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.974 -1.309 . . . . 0.0 110.223 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.521 ' OD1' ' CD1' ' A' ' 36' ' ' ILE . 3.4 t70 -57.14 -47.05 82.09 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.989 -1.069 . . . . 0.0 110.283 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.439 ' C ' ' O ' ' A' ' 97' ' ' ASP . 6.1 ptmt -47.62 -33.32 6.52 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 118.839 -1.145 . . . . 0.0 107.984 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 2.7 m -59.87 -40.33 88.29 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.522 HD13 ' HB ' ' A' ' 5' ' ' ILE . 95.6 mt -49.75 -60.4 2.92 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.537 ' C ' ' H ' ' A' ' 103' ' ' GLU . 21.6 t -53.36 -46.62 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -65.44 7.85 0.19 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.537 ' H ' ' C ' ' A' ' 101' ' ' VAL . 19.8 tt0 -100.05 -44.58 5.96 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.427 -0.796 . . . . 0.0 110.325 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.784 HG12 ' O ' ' A' ' 104' ' ' VAL . 77.2 t -126.01 60.05 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 O-C-N 121.233 -0.917 . . . . 0.0 110.839 -178.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.578 HG12 ' O ' ' A' ' 105' ' ' VAL . 4.2 t -130.52 96.94 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.075 -1.016 . . . . 0.0 109.56 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.585 ' C ' ' H ' ' A' ' 108' ' ' PHE . 35.0 mt-30 -120.2 -35.67 3.4 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.444 ' CG ' ' O ' ' A' ' 107' ' ' ASN . 36.6 t30 -62.53 35.45 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.7 -0.625 . . . . 0.0 110.298 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.585 ' H ' ' C ' ' A' ' 106' ' ' GLN . 0.6 OUTLIER -139.14 150.69 45.93 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.164 -0.96 . . . . 0.0 108.983 178.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.688 ' HB3' ' NZ ' ' A' ' 75' ' ' LYS . . . -79.48 -44.27 21.6 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.331 -0.856 . . . . 0.0 109.502 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -160.87 159.51 29.87 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.143 -0.973 . . . . 0.0 109.481 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.62 157.41 17.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.25 -0.906 . . . . 0.0 109.164 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -117.75 142.35 47.37 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.398 -0.814 . . . . 0.0 110.643 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.8 t -110.6 97.03 5.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 178.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.448 HG22 ' H ' ' A' ' 116' ' ' ASP . 10.3 mm -103.47 152.32 6.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 O-C-N 121.3 -0.875 . . . . 0.0 110.828 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.5 p -139.77 5.37 2.17 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.448 ' H ' HG22 ' A' ' 114' ' ' ILE . 0.2 OUTLIER -160.46 155.39 24.35 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.386 -0.821 . . . . 0.0 109.271 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 20.7 mtm180 -67.08 -24.12 65.93 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 0.0 109.769 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -69.33 -23.03 63.72 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.121 -0.987 . . . . 0.0 109.216 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.421 ' CB ' HG23 ' A' ' 114' ' ' ILE . 30.0 mt-10 -86.56 -1.89 58.02 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.389 -0.819 . . . . 0.0 109.648 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.687 HD22 ' CE1' ' A' ' 48' ' ' PHE . 2.9 mt -107.08 25.54 11.25 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.257 -0.902 . . . . 0.0 109.429 179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -82.98 146.32 28.85 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.403 -0.811 . . . . 0.0 109.646 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 1.001 ' HB2' ' NH2' ' A' ' 126' ' ' ARG . 0.2 OUTLIER -52.56 -55.32 23.04 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.132 -0.98 . . . . 0.0 109.338 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.11 -19.66 14.14 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.306 -0.872 . . . . 0.0 110.232 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.501 ' C ' ' CD1' ' A' ' 124' ' ' PHE . 16.5 t80 -86.86 -49.14 7.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.215 -0.928 . . . . 0.0 109.074 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.3 mm -75.96 -25.7 17.2 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.788 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 1.001 ' NH2' ' HB2' ' A' ' 122' ' ' GLU . 1.8 ttm-85 -73.04 -54.64 8.05 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.159 -0.963 . . . . 0.0 109.007 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.8 t -63.81 -12.39 35.32 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.412 -0.805 . . . . 0.0 109.578 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -84.82 -38.11 19.93 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.19 -0.944 . . . . 0.0 109.601 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.615 HD22 ' NZ ' ' A' ' 75' ' ' LYS . 92.2 mt -72.57 -39.99 66.98 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.187 -0.946 . . . . 0.0 109.315 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.991 ' HA ' ' HZ2' ' A' ' 130' ' ' LYS . 0.0 OUTLIER -62.4 -15.75 50.75 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.094 -1.004 . . . . 0.0 109.512 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.573 ' O ' ' N ' ' A' ' 133' ' ' GLY . 0.1 OUTLIER -75.29 -69.81 0.46 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.318 -0.864 . . . . 0.0 109.498 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -60.32 74.76 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.282 -0.886 . . . . 0.0 109.485 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.573 ' N ' ' O ' ' A' ' 131' ' ' LYS . . . -90.22 136.53 13.5 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 60.77 -173.37 5.92 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -172.59 -38.75 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.279 -1.13 . . . . 0.0 109.443 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.464 ' O ' ' O ' ' A' ' 140' ' ' GLN . 9.8 p-10 -73.51 8.87 1.58 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.361 -0.837 . . . . 0.0 109.548 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -92.05 -31.66 15.48 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.192 -0.942 . . . . 0.0 109.439 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -74.07 -29.72 62.02 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.26 -0.9 . . . . 0.0 109.507 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -95.34 -123.72 0.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.354 -0.841 . . . . 0.0 109.497 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.464 ' O ' ' O ' ' A' ' 136' ' ' ASN . 68.7 mm-40 -78.56 161.93 26.66 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.936 . . . . 0.0 109.426 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 14.1 p -87.58 52.27 2.44 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.266 -0.896 . . . . 0.0 109.531 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 118.028 -0.987 . . . . 0.0 109.464 179.997 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.2 mtt . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 121.283 0.563 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.29 9.37 0.42 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.319 -0.863 . . . . 0.0 109.446 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.617 HG21 ' OD1' ' A' ' 97' ' ' ASP . 0.5 OUTLIER -139.45 147.83 41.9 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.317 -0.864 . . . . 0.0 109.48 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -134.06 118.27 17.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.385 -0.822 . . . . 0.0 109.176 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -110.89 140.41 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.365 -0.834 . . . . 0.0 109.869 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 2.6 t70 -97.07 45.48 1.04 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.202 -0.936 . . . . 0.0 108.959 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.446 ' C ' ' O ' ' A' ' 6' ' ' ASP . 0.0 OUTLIER -40.46 -21.58 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.432 -0.793 . . . . 0.0 109.724 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.7 tt0 -52.88 -42.17 65.03 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.241 -0.912 . . . . 0.0 109.28 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.57 -67.04 0.47 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.192 -0.942 . . . . 0.0 109.419 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.646 ' SG ' ' CE2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -44.69 -60.59 1.93 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.206 -0.934 . . . . 0.0 109.701 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.568 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 11.3 ttp180 -44.22 -58.54 2.82 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.927 -1.108 . . . . 0.0 109.778 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.68 -28.94 16.27 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.062 -1.024 . . . . 0.0 109.229 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.946 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -87.69 -50.92 6.17 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.198 -0.938 . . . . 0.0 109.776 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.481 ' OH ' HD12 ' A' ' 78' ' ' LEU . 6.1 m-85 -45.74 -56.17 5.62 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.242 -0.911 . . . . 0.0 109.941 -179.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.779 ' H ' ' ND2' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -64.25 -40.1 95.31 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.11 -0.994 . . . . 0.0 109.411 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -66.6 -25.5 66.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.285 -0.884 . . . . 0.0 109.275 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.946 HG23 ' O ' ' A' ' 13' ' ' ALA . 29.6 t -80.88 -13.9 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.245 -0.909 . . . . 0.0 109.377 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.481 ' O ' ' O ' ' A' ' 19' ' ' ASP . 56.5 mtm180 -73.13 -17.85 61.35 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.241 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.584 ' OD2' ' N ' ' A' ' 22' ' ' SER . 54.1 p-10 -59.44 -145.7 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.298 -0.876 . . . . 0.0 109.487 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.12 4.81 34.56 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.313 -0.867 . . . . 0.0 108.854 179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.543 ' H ' ' CG ' ' A' ' 19' ' ' ASP . . . 127.05 67.07 0.15 Allowed Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.15 -1.58 . . . . 0.0 109.15 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.728 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -65.1 -32.14 73.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.158 -1.201 . . . . 0.0 109.633 -179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.728 ' HB2' ' O ' ' A' ' 22' ' ' SER . . . 158.92 -77.49 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.498 -0.751 . . . . 0.0 110.191 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.793 HG23 ' O ' ' A' ' 24' ' ' VAL . 12.4 m -59.35 70.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.31 -0.869 . . . . 0.0 110.449 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.806 HG23 ' CD1' ' A' ' 26' ' ' TRP . 2.2 tt -45.69 -41.73 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.923 -1.11 . . . . 0.0 108.366 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.806 ' CD1' HG23 ' A' ' 25' ' ' ILE . 33.2 p-90 -142.95 136.97 29.07 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.714 -1.241 . . . . 0.0 109.776 177.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -115.24 144.87 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.42 -0.8 . . . . 0.0 110.107 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.598 ' HB ' HD13 ' A' ' 58' ' ' LEU . 6.4 p -133.71 144.02 48.87 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.429 -0.795 . . . . 0.0 110.972 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.646 ' CE2' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -129.42 130.05 45.47 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 179.297 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -107.7 149.43 28.15 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.465 -0.772 . . . . 0.0 109.597 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.405 ' OH ' HG23 ' A' ' 94' ' ' THR . 6.0 m-85 -49.02 98.73 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.455 -0.778 . . . . 0.0 109.912 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.64 101.61 13.48 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 178.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 61.94 -119.07 16.59 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.08 22.83 15.39 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.394 -1.062 . . . . 0.0 110.015 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 3.2 m -145.7 129.35 17.1 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.19 -0.944 . . . . 0.0 109.765 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.747 ' N ' HD12 ' A' ' 36' ' ' ILE . 1.6 mp -78.54 113.84 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.14 -0.975 . . . . 0.0 108.947 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.424 ' O ' ' C ' ' A' ' 38' ' ' PRO . 0.7 OUTLIER -135.58 153.7 77.77 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.285 -0.884 . . . . 0.0 109.822 -179.304 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.424 ' C ' ' O ' ' A' ' 37' ' ' VAL . 93.9 Cg_exo -32.02 145.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.357 0 C-N-CA 122.989 2.46 . . . . 0.0 112.26 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -139.1 -33.38 0.17 Allowed Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.542 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -143.28 -179.0 6.13 Favored 'General case' 0 C--N 1.294 -1.832 0 O-C-N 121.715 -0.873 . . . . 0.0 109.276 -179.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.779 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -153.17 -171.53 3.95 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.797 0.808 . . . . 0.0 110.838 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.68 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -166.71 128.2 1.71 Allowed Glycine 0 N--CA 1.483 1.822 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -105.08 -10.04 17.43 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -155.35 172.05 18.85 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.467 ' OH ' ' O ' ' A' ' 120' ' ' LEU . 9.4 t80 -70.22 -45.83 65.75 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 120.895 -1.128 . . . . 0.0 109.332 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.458 ' N ' ' CD ' ' A' ' 46' ' ' GLN . 1.2 mp0 -46.94 -39.19 11.84 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.083 -1.011 . . . . 0.0 110.087 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.664 ' CE1' HE22 ' A' ' 41' ' ' GLN . 0.4 OUTLIER -53.18 -24.65 11.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.156 -0.965 . . . . 0.0 109.728 -179.696 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.576 ' O ' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -72.3 -25.77 61.71 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.175 -0.953 . . . . 0.0 109.074 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.447 HG12 ' CE2' ' A' ' 48' ' ' PHE . 7.4 mt -83.35 -15.81 11.41 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.692 0 O-C-N 121.104 -0.998 . . . . 0.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.514 ' O ' ' NE2' ' A' ' 50' ' ' GLN . 13.6 tp60 -88.3 -53.18 4.82 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.986 -1.071 . . . . 0.0 110.665 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.614 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -102.79 55.87 0.77 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.509 -0.745 . . . . 0.0 111.681 -177.427 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.576 ' SG ' ' O ' ' A' ' 48' ' ' PHE . 34.4 m -155.38 63.64 0.62 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.93 -1.106 . . . . 0.0 109.792 179.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.596 ' C ' ' H ' ' A' ' 55' ' ' ASP . 10.2 p -87.75 158.67 18.73 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.146 -0.971 . . . . 0.0 110.029 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -60.23 12.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.333 -0.854 . . . . 0.0 110.56 -179.69 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.596 ' H ' ' C ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -111.23 27.79 9.35 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 109.878 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.536 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.0 OUTLIER -148.21 148.76 15.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.087 -1.008 . . . . 0.0 109.816 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.561 ' CD ' ' H ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -125.99 128.75 47.96 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.459 -0.776 . . . . 0.0 109.625 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.598 HD13 ' HB ' ' A' ' 28' ' ' THR . 2.7 pp -172.64 -173.38 1.0 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.046 -1.034 . . . . 0.0 109.985 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.564 ' CD1' ' N ' ' A' ' 59' ' ' PHE . 3.4 m-85 -114.68 159.18 20.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.354 -0.842 . . . . 0.0 108.812 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.462 ' O ' ' N ' ' A' ' 79' ' ' ILE . . . -139.34 150.99 46.01 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.789 -1.194 . . . . 0.0 109.143 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.516 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 28.1 t80 -148.86 97.11 2.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.175 -0.953 . . . . 0.0 109.181 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -117.07 152.64 18.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.23 -0.919 . . . . 0.0 109.071 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.9 119.07 22.26 Favored 'General case' 0 C--N 1.298 -1.648 0 O-C-N 121.491 -0.756 . . . . 0.0 109.163 179.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -100.47 156.22 17.39 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.262 -0.899 . . . . 0.0 109.573 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 10.0 t -77.73 141.64 39.19 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.17 -0.956 . . . . 0.0 108.975 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.426 ' HB ' ' HB2' ' A' ' 69' ' ' ALA . 1.7 m -109.9 -24.05 11.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.472 -0.767 . . . . 0.0 109.42 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.581 ' O ' ' N ' ' A' ' 69' ' ' ALA . . . 81.04 106.33 0.32 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 59.34 -76.11 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.228 -1.16 . . . . 0.0 109.465 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 67' ' ' GLY . . . 50.81 -169.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 0.0 109.423 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.486 ' C ' ' H ' ' A' ' 72' ' ' LYS . 0.0 OUTLIER -137.83 121.83 17.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.46 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.14 1.22 0.33 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.315 -0.866 . . . . 0.0 109.455 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.486 ' H ' ' C ' ' A' ' 70' ' ' MET . 77.8 mttt -147.98 62.97 1.12 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.198 -0.939 . . . . 0.0 109.465 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 72' ' ' LYS . 2.3 mtt180 -43.29 -54.47 4.58 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.193 -0.942 . . . . 0.0 109.475 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.87 157.03 17.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.268 -0.895 . . . . 0.0 109.524 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.8 mmtt -104.63 158.09 16.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.399 -0.813 . . . . 0.0 109.813 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.49 ' O ' ' N ' ' A' ' 109' ' ' ALA . 65.7 m-85 -133.5 118.99 18.97 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.486 -0.759 . . . . 0.0 109.459 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.28 160.33 41.66 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.127 -0.983 . . . . 0.0 110.407 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.481 HD12 ' OH ' ' A' ' 14' ' ' TYR . 5.3 tt -105.99 157.13 17.73 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.593 HG21 HD11 ' A' ' 120' ' ' LEU . 2.8 mt -135.13 136.1 51.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.072 -1.017 . . . . 0.0 108.961 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -95.96 117.16 30.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.064 -1.022 . . . . 0.0 109.79 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.584 ' N ' ' O ' ' A' ' 58' ' ' LEU . 66.8 t-105 -95.22 111.25 23.12 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.163 -0.961 . . . . 0.0 109.869 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.415 ' O ' ' C ' ' A' ' 83' ' ' GLY . 4.4 mm -116.41 92.77 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 N-CA-C 108.339 -0.985 . . . . 0.0 108.339 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.415 ' C ' ' O ' ' A' ' 82' ' ' ILE . . . -43.66 161.77 0.06 OUTLIER Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.848 -1.301 . . . . 0.0 109.848 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -88.85 -27.49 21.01 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.344 -1.092 . . . . 0.0 109.565 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.9 47.59 0.87 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.323 -0.86 . . . . 0.0 109.664 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.5 m -102.23 166.26 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 121.286 -0.884 . . . . 0.0 109.733 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.533 ' OG ' ' N ' ' A' ' 88' ' ' GLY . 11.2 t -87.11 -170.92 3.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.398 -0.814 . . . . 0.0 109.748 -179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.533 ' N ' ' OG ' ' A' ' 87' ' ' SER . . . -84.2 -16.64 66.56 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -45.93 -41.37 11.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.134 -1.215 . . . . 0.0 109.822 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.651 ' H ' ' CD ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -68.76 -29.38 67.76 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.113 -0.992 . . . . 0.0 109.076 179.641 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.439 ' N ' ' O ' ' A' ' 88' ' ' GLY . 10.0 tmm_? -53.59 -60.78 2.87 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 110.206 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.62 -42.63 34.27 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.11 -0.994 . . . . 0.0 110.131 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -61.96 -63.65 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.102 -0.999 . . . . 0.0 110.049 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.405 HG23 ' OH ' ' A' ' 31' ' ' TYR . 13.6 m -45.33 -51.56 10.92 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.152 -0.967 . . . . 0.0 109.806 -179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.4 ' C ' ' O ' ' A' ' 94' ' ' THR . . . -43.19 -65.46 1.45 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -49.48 72.93 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.106 -1.232 . . . . 0.0 111.34 -178.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.617 ' OD1' HG21 ' A' ' 3' ' ' THR . 0.1 OUTLIER -68.23 -39.75 82.22 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.87 -1.144 . . . . 0.0 111.593 -177.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -23.95 64.67 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 120.732 -1.23 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 85.0 m -83.32 -20.52 34.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 108.694 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -79.56 -61.22 2.07 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.433 -0.792 . . . . 0.0 109.366 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 4.1 p -56.46 -28.37 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.244 -0.91 . . . . 0.0 109.971 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.864 ' O ' HG12 ' A' ' 105' ' ' VAL . 16.4 tttt -71.55 -39.56 70.57 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.127 -0.983 . . . . 0.0 109.708 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.62 -31.4 69.49 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.111 -0.993 . . . . 0.0 110.097 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 2.6 t -97.14 36.92 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.003 -1.06 . . . . 0.0 110.211 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.864 HG12 ' O ' ' A' ' 102' ' ' LYS . 8.4 p -119.53 66.02 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.272 -0.892 . . . . 0.0 109.404 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.15 42.65 1.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.204 -0.935 . . . . 0.0 109.802 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.759 ' ND2' HD22 ' A' ' 15' ' ' ASN . 4.3 m-20 -136.33 -31.04 0.9 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.3 -0.875 . . . . 0.0 109.461 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.553 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -72.78 -164.65 0.17 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.323 -0.861 . . . . 0.0 110.104 179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.49 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -132.6 -27.58 1.71 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.504 -0.747 . . . . 0.0 109.091 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 21.3 tttp -162.2 150.63 14.87 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.304 -0.873 . . . . 0.0 109.404 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.81 149.23 25.83 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.241 -0.912 . . . . 0.0 109.278 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -135.74 153.98 51.39 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.343 -0.848 . . . . 0.0 109.966 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 5.8 p -120.9 137.7 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.65 HG22 ' H ' ' A' ' 116' ' ' ASP . 4.4 mm -127.07 160.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.858 . . . . 0.0 110.433 -179.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.518 ' N ' HG22 ' A' ' 114' ' ' ILE . 14.3 t -140.63 5.64 2.01 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.65 ' H ' HG22 ' A' ' 114' ' ' ILE . 49.6 m-20 -146.06 155.3 42.69 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.37 -0.831 . . . . 0.0 109.392 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -75.99 -30.93 58.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.241 -0.912 . . . . 0.0 110.045 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -76.17 -7.73 55.47 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.145 -0.972 . . . . 0.0 109.368 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.907 ' OE1' ' CE1' ' A' ' 124' ' ' PHE . 2.4 mm-40 -86.58 3.87 42.56 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.205 -0.934 . . . . 0.0 109.785 -179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.593 HD11 HG21 ' A' ' 79' ' ' ILE . 1.6 tp -98.91 -0.35 42.46 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.236 -0.915 . . . . 0.0 108.993 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -52.19 144.41 12.55 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.578 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 122' ' ' GLU . 1.0 OUTLIER -61.36 -48.58 80.62 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.244 -0.91 . . . . 0.0 109.78 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -56.23 -20.42 18.16 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.226 -0.921 . . . . 0.0 109.679 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.907 ' CE1' ' OE1' ' A' ' 119' ' ' GLU . 78.3 t80 -86.67 -50.69 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.169 -0.957 . . . . 0.0 109.269 179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -73.7 -25.62 20.89 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.707 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -69.47 -51.83 32.35 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.25 -0.906 . . . . 0.0 109.174 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 30.3 t -63.81 -17.95 63.62 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.275 -0.89 . . . . 0.0 109.325 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -73.06 -42.11 63.43 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.238 -0.914 . . . . 0.0 109.265 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 34.9 mt -73.19 -51.13 18.94 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.276 -0.89 . . . . 0.0 109.099 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -53.88 -15.85 1.53 Allowed 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.139 -0.976 . . . . 0.0 109.586 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -74.84 -68.42 0.55 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.273 -0.892 . . . . 0.0 109.451 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -72.89 76.51 1.16 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.22 -0.925 . . . . 0.0 109.479 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -92.68 94.83 1.93 Allowed Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 54.12 -118.39 9.11 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -143.61 22.07 1.82 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.26 -1.141 . . . . 0.0 109.502 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.441 ' OD1' ' N ' ' A' ' 136' ' ' ASN . 1.5 m120 -61.93 -34.82 76.79 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.165 -0.959 . . . . 0.0 109.517 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -83.67 2.12 39.15 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.277 -0.889 . . . . 0.0 109.519 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.45 -37.08 12.14 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 109.471 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -100.79 10.43 41.15 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.287 -0.883 . . . . 0.0 109.472 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -154.91 109.68 3.01 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.24 -0.913 . . . . 0.0 109.492 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 39.3 p -90.21 -154.09 0.32 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.224 -0.922 . . . . 0.0 109.511 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 117.96 -1.019 . . . . 0.0 109.454 180.0 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.678 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.678 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 76.05 159.32 0.21 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.419 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.7 m -158.02 147.57 19.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.21 -0.932 . . . . 0.0 109.457 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HB3' HG23 ' A' ' 35' ' ' THR . 5.0 tptm -134.16 118.36 17.57 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.371 -0.831 . . . . 0.0 109.246 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.59 139.74 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.401 -0.812 . . . . 0.0 109.483 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -99.26 63.2 1.29 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.117 -0.99 . . . . 0.0 109.562 -179.797 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.724 ' H ' ' CD ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -43.71 -20.93 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.112 -0.993 . . . . 0.0 109.205 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 6' ' ' ASP . 2.5 tt0 -52.79 -50.44 63.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.267 -0.895 . . . . 0.0 108.96 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.98 -66.11 0.59 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.27 -0.894 . . . . 0.0 109.122 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.621 ' SG ' ' CE1' ' A' ' 29' ' ' PHE . 3.0 m -47.09 -68.08 0.22 Allowed 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.2 -0.938 . . . . 0.0 109.739 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.578 ' O ' ' ND2' ' A' ' 15' ' ' ASN . 4.1 ttt180 -45.15 -54.32 6.99 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.936 -1.103 . . . . 0.0 109.595 -179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 8' ' ' GLU . . . -58.98 -52.94 63.62 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.344 -0.848 . . . . 0.0 110.195 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.12 -19.65 64.85 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.021 -1.049 . . . . 0.0 110.03 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.3 m-85 -70.68 -49.83 43.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.174 -0.954 . . . . 0.0 109.936 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.801 HD22 HD22 ' A' ' 107' ' ' ASN . 0.0 OUTLIER -81.68 -15.56 54.08 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.229 -0.919 . . . . 0.0 110.116 -179.194 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' A' ' 18' ' ' ARG . 4.7 tp -66.56 -49.79 65.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.885 -1.134 . . . . 0.0 109.303 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.541 ' CG1' ' O ' ' A' ' 24' ' ' VAL . 16.5 m -58.72 -2.31 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.318 -0.864 . . . . 0.0 109.631 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.587 ' NE ' ' O ' ' A' ' 15' ' ' ASN . 0.1 OUTLIER -79.65 -7.96 58.9 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.241 -0.912 . . . . 0.0 109.137 179.829 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.574 ' O ' ' N ' ' A' ' 21' ' ' GLY . 0.1 OUTLIER -92.34 158.09 16.28 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.24 -0.913 . . . . 0.0 109.444 179.896 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.69 38.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.202 -0.936 . . . . 0.0 109.815 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 19' ' ' ASP . . . 174.35 -91.77 0.09 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.729 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.7 OUTLIER 74.15 -55.11 0.67 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.391 -1.064 . . . . 0.0 109.487 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.729 ' HB3' ' O ' ' A' ' 22' ' ' SER . . . 84.16 52.82 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.478 0.656 . . . . 0.0 109.453 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.804 HG22 ' O ' ' A' ' 24' ' ' VAL . 3.4 p -178.35 52.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.709 HG22 ' O ' ' A' ' 42' ' ' GLY . 11.8 tt -38.16 -39.0 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.597 -0.689 . . . . 0.0 110.616 -178.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.695 ' CH2' ' O ' ' A' ' 41' ' ' GLN . 56.4 p-90 -150.58 163.8 37.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.394 -1.441 . . . . 0.0 110.279 178.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.441 ' CG1' ' CG2' ' A' ' 24' ' ' VAL . 31.7 m -140.36 134.24 34.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.349 -0.844 . . . . 0.0 109.307 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.688 HG23 ' CZ3' ' A' ' 26' ' ' TRP . 65.1 p -119.61 137.27 53.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.323 -0.861 . . . . 0.0 108.804 179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.621 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -121.15 159.6 25.48 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 178.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.57 146.81 38.53 Favored 'General case' 0 C--N 1.295 -1.793 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.713 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.771 ' OH ' HG23 ' A' ' 94' ' ' THR . 0.1 OUTLIER -60.31 100.55 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.472 -0.767 . . . . 0.0 110.009 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.792 ' O ' ' N ' ' A' ' 34' ' ' ALA . 0.3 OUTLIER -97.99 96.03 7.88 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.887 -1.125 . . . . 0.0 108.427 179.007 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' A' ' 32' ' ' ASP . . . 6.43 46.43 0.0 OUTLIER Glycine 0 N--CA 1.51 3.586 0 C-N-CA 123.368 0.509 . . . . 0.0 112.634 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.792 ' N ' ' O ' ' A' ' 32' ' ' ASP . . . -178.27 -72.55 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.762 -1.434 . . . . 0.0 108.884 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.532 HG23 ' HB3' ' A' ' 4' ' ' LYS . 20.5 m -136.69 150.26 48.36 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.665 -178.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' OD2' ' A' ' 6' ' ' ASP . 2.2 mp -78.69 97.0 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -120.1 148.2 46.42 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.246 -0.909 . . . . 0.0 110.861 -178.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -40.09 113.91 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.241 0 C-N-CA 123.029 2.486 . . . . 0.0 112.501 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.434 ' H ' ' HA ' ' A' ' 29' ' ' PHE . . . -91.95 -26.4 19.43 Favored Glycine 0 N--CA 1.488 2.144 0 N-CA-C 109.07 -1.612 . . . . 0.0 109.07 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.544 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -143.94 -178.67 6.05 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.659 -0.906 . . . . 0.0 109.471 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.695 ' O ' ' CH2' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -134.28 179.37 6.31 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-O 121.628 0.728 . . . . 0.0 110.481 -179.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.709 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -133.65 114.47 1.36 Allowed Glycine 0 N--CA 1.484 1.834 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -117.76 -34.23 4.28 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 178.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -127.75 138.85 52.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -13.15 28.79 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.029 -1.044 . . . . 0.0 109.476 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -83.27 -31.84 26.73 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.133 -0.979 . . . . 0.0 109.478 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.65 -41.87 98.16 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.188 -0.945 . . . . 0.0 109.245 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.614 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -57.42 -40.23 77.9 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.446 HG12 ' CE2' ' A' ' 48' ' ' PHE . 3.4 mm -64.81 -32.65 58.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.457 -0.777 . . . . 0.0 111.921 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.591 ' O ' HG23 ' A' ' 53' ' ' THR . 0.9 OUTLIER -87.07 -19.03 29.18 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.416 -1.427 . . . . 0.0 108.091 179.755 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.602 ' O ' ' N ' ' A' ' 53' ' ' THR . 4.3 mm100 -74.8 -73.04 0.26 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.493 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.463 ' SG ' HD21 ' A' ' 120' ' ' LEU . 3.9 p -61.01 66.75 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.366 -0.834 . . . . 0.0 110.025 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.602 ' N ' ' O ' ' A' ' 51' ' ' GLN . 8.7 p -81.22 176.25 9.92 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.157 -0.964 . . . . 0.0 109.743 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -44.48 90.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 109.97 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.51 36.09 0.25 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -0.973 . . . . 0.0 109.851 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.595 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 41.5 t -148.38 146.29 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.16 -0.962 . . . . 0.0 109.909 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.521 ' H ' ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -135.34 123.07 22.32 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.46 -0.775 . . . . 0.0 109.637 179.918 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 58' ' ' LEU . 3.2 pp -172.73 -178.25 1.86 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.877 -1.14 . . . . 0.0 110.65 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.553 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.46 152.25 30.36 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -133.79 157.88 44.78 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.105 -0.997 . . . . 0.0 109.372 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.422 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 35.5 t80 -149.57 100.17 2.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.107 -0.996 . . . . 0.0 109.025 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -119.89 153.37 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.923 . . . . 0.0 109.197 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.825 ' CZ ' ' HB2' ' A' ' 74' ' ' SER . 14.7 ttt180 -89.17 126.15 35.35 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.364 -0.835 . . . . 0.0 109.324 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.633 ' O ' ' OG ' ' A' ' 74' ' ' SER . 49.7 m-85 -107.9 157.62 18.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.457 -0.777 . . . . 0.0 109.481 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 97.2 m -91.78 146.67 23.57 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.896 . . . . 0.0 109.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.467 ' O ' ' OG1' ' A' ' 66' ' ' THR . 0.1 OUTLIER -109.82 77.29 1.04 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.415 -0.803 . . . . 0.0 109.421 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.1 130.36 4.24 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.737 ' N ' ' OD1' ' A' ' 68' ' ' ASP . 0.0 OUTLIER -79.08 91.66 4.92 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -1.133 . . . . 0.0 109.481 179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.7 ' HB2' ' O ' ' A' ' 68' ' ' ASP . . . 164.83 132.08 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.23 -0.919 . . . . 0.0 109.445 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.552 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 6.3 tpt 54.88 -82.78 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.227 -0.921 . . . . 0.0 109.46 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.578 ' N ' ' O ' ' A' ' 69' ' ' ALA . 1.7 m 54.01 80.27 0.12 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.254 -0.904 . . . . 0.0 109.42 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -86.53 -11.39 51.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.235 -0.916 . . . . 0.0 109.56 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' SER . 4.8 mtt180 -159.33 96.27 1.29 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.248 -0.907 . . . . 0.0 109.634 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.825 ' HB2' ' CZ ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -50.45 -178.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.278 -0.889 . . . . 0.0 109.4 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.714 ' HD3' HD13 ' A' ' 129' ' ' LEU . 5.2 ptpt -108.74 129.43 55.36 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.293 -0.88 . . . . 0.0 108.986 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.471 ' CZ ' ' HD2' ' A' ' 63' ' ' ARG . 97.5 m-85 -109.38 125.21 52.14 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 109.945 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.53 167.48 22.41 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.212 -0.93 . . . . 0.0 110.93 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.454 HD12 ' OH ' ' A' ' 14' ' ' TYR . 4.8 tt -121.51 156.32 33.07 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.62 ' CG2' HD12 ' A' ' 114' ' ' ILE . 31.2 mt -136.26 135.79 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.881 -1.137 . . . . 0.0 108.965 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.441 HG23 ' CD2' ' A' ' 59' ' ' PHE . 4.9 m -95.92 122.81 39.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.1 -1.0 . . . . 0.0 109.708 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.595 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 59.2 t-105 -100.85 111.85 24.16 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.214 -0.929 . . . . 0.0 109.804 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 80' ' ' THR . 24.5 mm -110.78 92.88 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -55.01 155.3 8.96 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.761 -1.336 . . . . 0.0 109.761 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -91.59 -17.35 25.72 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -1.176 . . . . 0.0 109.615 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -102.99 39.63 1.52 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.174 -0.954 . . . . 0.0 109.546 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 m -106.37 157.14 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.339 -0.851 . . . . 0.0 109.539 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -77.9 -174.72 3.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.926 . . . . 0.0 109.701 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.88 -18.4 63.44 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 89' ' ' LEU . 10.9 mp -46.57 -50.95 16.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.138 -1.213 . . . . 0.0 109.173 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.525 ' CD ' ' N ' ' A' ' 90' ' ' GLN . 2.9 mm100 -60.41 -31.72 70.66 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.21 -0.931 . . . . 0.0 108.822 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -47.82 -67.02 0.31 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.147 -0.971 . . . . 0.0 109.886 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.401 ' O ' HG22 ' A' ' 96' ' ' THR . . . -66.16 -35.88 81.63 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.221 -0.924 . . . . 0.0 110.319 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.554 ' O ' ' N ' ' A' ' 95' ' ' GLY . 27.3 mttm -74.87 -69.94 0.44 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.137 -0.977 . . . . 0.0 109.985 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.771 HG23 ' OH ' ' A' ' 31' ' ' TYR . 63.7 m -45.36 -14.44 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.307 -0.87 . . . . 0.0 110.056 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.554 ' N ' ' O ' ' A' ' 93' ' ' LYS . . . -79.71 -64.85 1.83 Allowed Glycine 0 N--CA 1.489 2.221 0 C-N-CA 119.603 -1.284 . . . . 0.0 110.113 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.401 HG22 ' O ' ' A' ' 92' ' ' ALA . 0.6 OUTLIER -70.12 -39.08 75.67 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.033 -1.275 . . . . 0.0 110.592 -178.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.415 ' OD2' HD13 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -60.55 -42.05 95.78 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.808 -1.182 . . . . 0.0 110.561 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -62.89 -32.39 73.64 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 120.757 -1.214 . . . . 0.0 108.811 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.04 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.313 -0.867 . . . . 0.0 108.813 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 104' ' ' VAL . 1.8 mt -81.47 -53.61 6.14 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.395 -0.816 . . . . 0.0 109.312 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 2.5 p -64.64 -17.12 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.427 ' O ' HG12 ' A' ' 105' ' ' VAL . 15.4 tttt -82.67 -41.07 19.84 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.047 -1.033 . . . . 0.0 110.443 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.9 -23.16 48.8 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.903 -1.123 . . . . 0.0 110.521 -178.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 104' ' ' VAL . 14.9 p -100.47 34.75 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.926 -1.109 . . . . 0.0 110.156 -179.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 105' ' ' VAL . 2.6 p -133.2 126.77 53.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.225 -0.922 . . . . 0.0 109.791 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -134.41 -32.99 1.01 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.438 -0.789 . . . . 0.0 109.149 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.801 HD22 HD22 ' A' ' 15' ' ' ASN . 2.6 t-20 -49.58 -32.05 11.84 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.226 -0.921 . . . . 0.0 108.955 -179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -74.44 162.02 29.24 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.272 -0.893 . . . . 0.0 109.852 179.741 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -101.13 -31.95 10.8 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -162.47 145.26 11.17 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.447 -0.783 . . . . 0.0 109.241 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.408 ' OE1' ' C ' ' A' ' 111' ' ' GLU . 0.2 OUTLIER -104.86 156.86 17.64 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.197 -0.939 . . . . 0.0 109.302 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -133.99 155.79 49.33 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.314 -0.866 . . . . 0.0 109.779 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 16.9 t -115.5 138.99 44.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.62 HD12 ' CG2' ' A' ' 79' ' ' ILE . 23.4 mt -138.34 149.98 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.13 -0.981 . . . . 0.0 110.283 -179.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -140.59 10.52 2.26 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -146.66 155.84 42.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.478 -0.764 . . . . 0.0 109.382 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 -74.29 -32.45 62.9 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.164 -0.96 . . . . 0.0 109.63 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.501 ' O ' ' CG ' ' A' ' 121' ' ' GLU . 17.5 mmtp -58.49 -14.88 8.95 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.09 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -88.15 -4.82 58.69 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.479 -0.763 . . . . 0.0 109.868 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.587 ' N ' ' OE2' ' A' ' 121' ' ' GLU . 9.2 mp -91.35 26.73 2.15 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.214 -0.929 . . . . 0.0 110.51 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.587 ' OE2' ' N ' ' A' ' 120' ' ' LEU . 0.2 OUTLIER -91.05 143.75 26.37 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.785 -1.197 . . . . 0.0 109.847 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.661 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -62.59 -52.98 61.26 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.17 -0.956 . . . . 0.0 109.0 179.592 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . 0.477 ' N ' ' OE1' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.89 -14.84 17.28 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.325 -0.859 . . . . 0.0 109.952 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -85.31 -48.32 9.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.127 -0.983 . . . . 0.0 108.797 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -75.58 -23.54 16.7 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -68.31 -54.63 16.15 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 2.6 m -62.9 -20.61 65.32 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.305 -0.872 . . . . 0.0 109.086 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -85.27 -39.75 17.37 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.443 -0.786 . . . . 0.0 109.141 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.714 HD13 ' HD3' ' A' ' 75' ' ' LYS . 3.3 mt -76.14 -37.85 57.49 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.33 -7.73 0.26 Allowed 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 178.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.549 ' H ' ' C ' ' A' ' 129' ' ' LEU . 7.3 ttpp 61.26 104.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-O 121.797 0.808 . . . . 0.0 109.338 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -139.25 -32.35 0.66 Allowed 'General case' 0 C--N 1.3 -1.574 0 C-N-CA 119.836 -0.746 . . . . 0.0 109.59 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -47.33 162.43 0.26 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . -137.58 167.15 24.88 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 137' ' ' TYR . . . -162.87 24.47 0.09 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.22 -1.164 . . . . 0.0 109.501 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.552 ' N ' ' ND2' ' A' ' 136' ' ' ASN . 0.6 OUTLIER 65.94 -74.02 0.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 109.567 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.457 ' N ' ' O ' ' A' ' 135' ' ' ALA . 74.4 t80 53.05 6.74 0.06 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.276 -0.89 . . . . 0.0 109.438 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.503 ' H ' ' C ' ' A' ' 136' ' ' ASN . 12.6 t0 -165.29 -87.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.214 -0.929 . . . . 0.0 109.506 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -145.86 83.48 1.64 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.263 -0.898 . . . . 0.0 109.527 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 48.84 -99.52 0.06 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.241 -0.912 . . . . 0.0 109.432 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -173.36 4.06 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.242 -0.911 . . . . 0.0 109.438 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.515 -179.982 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 mtt . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.331 0.586 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 3' ' ' THR . . . -70.86 140.2 51.05 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.204 -0.935 . . . . 0.0 109.476 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.473 ' O ' ' O ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER 60.33 138.67 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -0.887 . . . . 0.0 109.513 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -140.95 118.24 11.38 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.302 -0.874 . . . . 0.0 109.344 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 1.614 HD11 ' CG1' ' A' ' 101' ' ' VAL . 15.0 tt -107.53 146.39 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.308 -0.87 . . . . 0.0 109.626 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.58 ' O ' ' N ' ' A' ' 8' ' ' GLU . 3.8 p30 -75.72 -51.99 11.47 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.083 -1.01 . . . . 0.0 110.829 -178.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.8 ' CD ' HG21 ' A' ' 104' ' ' VAL . 5.7 mttm 64.29 -43.06 0.28 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.296 -0.877 . . . . 0.0 109.797 -179.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.58 ' N ' ' O ' ' A' ' 6' ' ' ASP . 1.8 tm-20 -46.36 -38.83 9.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 109.843 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.9 -60.03 2.47 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.188 -0.945 . . . . 0.0 109.487 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.685 ' SG ' ' CE1' ' A' ' 14' ' ' TYR . 0.1 OUTLIER -44.91 -69.65 0.13 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.377 -0.827 . . . . 0.0 110.159 -179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -45.45 -56.18 5.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 -179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.63 -43.96 69.14 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.189 -0.945 . . . . 0.0 110.253 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.657 ' O ' HG13 ' A' ' 17' ' ' VAL . . . -78.01 -45.61 23.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.007 -1.058 . . . . 0.0 110.369 -179.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.685 ' CE1' ' SG ' ' A' ' 10' ' ' CYS . 3.0 m-30 -45.43 -55.2 6.37 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.289 -0.882 . . . . 0.0 110.249 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.724 HD22 ' ND2' ' A' ' 107' ' ' ASN . 0.3 OUTLIER -71.23 -21.64 62.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.062 -1.024 . . . . 0.0 109.803 -179.541 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.7 tp -72.18 -41.2 67.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.215 -0.928 . . . . 0.0 109.872 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.657 HG13 ' O ' ' A' ' 13' ' ' ALA . 0.9 OUTLIER -69.82 -10.22 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.062 -1.024 . . . . 0.0 109.462 -179.754 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.534 ' O ' ' N ' ' A' ' 20' ' ' ASP . 10.0 ttm180 -76.87 -25.7 53.38 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.239 -0.913 . . . . 0.0 109.306 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -65.45 64.94 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.286 -0.884 . . . . 0.0 109.512 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.534 ' N ' ' O ' ' A' ' 18' ' ' ARG . 33.5 m-20 52.05 25.42 3.18 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.168 -0.958 . . . . 0.0 109.666 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.78 53.9 24.97 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.36 4.81 52.63 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.289 -1.124 . . . . 0.0 109.671 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -140.9 -135.93 0.11 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.149 -0.969 . . . . 0.0 109.988 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.541 ' CG2' ' O ' ' A' ' 26' ' ' TRP . 0.5 OUTLIER -70.06 128.66 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.415 -0.803 . . . . 0.0 109.907 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.823 HG23 ' CD1' ' A' ' 26' ' ' TRP . 12.3 tt -61.89 -34.26 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.108 -0.995 . . . . 0.0 108.757 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.823 ' CD1' HG23 ' A' ' 25' ' ' ILE . 32.1 p-90 -160.29 151.96 19.86 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.268 -0.895 . . . . 0.0 109.386 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.6 m -119.22 141.67 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.442 -0.786 . . . . 0.0 109.355 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.586 ' HB ' HD13 ' A' ' 58' ' ' LEU . 41.3 p -131.99 136.31 47.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.32 -0.863 . . . . 0.0 109.547 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.496 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -117.36 163.86 15.72 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 179.121 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.452 ' O ' ' C ' ' A' ' 31' ' ' TYR . 10.6 ptm180 -140.81 147.76 39.54 Favored 'General case' 0 C--N 1.289 -2.029 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.443 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.661 ' OH ' ' OD1' ' A' ' 97' ' ' ASP . 3.9 m-85 -39.85 98.68 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.73 -0.607 . . . . 0.0 110.241 -178.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 1.184 ' OD1' ' O ' ' A' ' 35' ' ' THR . 0.0 OUTLIER -96.86 101.42 13.0 Favored 'General case' 0 C--N 1.302 -1.498 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.554 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 51.5 -119.89 9.09 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 108.683 -1.767 . . . . 0.0 108.683 -178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -106.96 21.58 17.33 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.364 -1.08 . . . . 0.0 110.095 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 1.184 ' O ' ' OD1' ' A' ' 32' ' ' ASP . 1.4 m -142.3 133.1 25.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 109.781 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.478 HD11 ' CE1' ' A' ' 31' ' ' TYR . 1.6 mp -80.64 110.56 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.258 -0.901 . . . . 0.0 109.349 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.932 HG13 ' OD1' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -135.5 153.49 77.76 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.358 -0.839 . . . . 0.0 109.63 -179.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.402 ' C ' ' O ' ' A' ' 37' ' ' VAL . 86.4 Cg_exo -33.84 146.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.993 2.462 . . . . 0.0 112.316 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -143.2 -26.36 0.15 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.545 ' CG ' ' NE2' ' A' ' 51' ' ' GLN . 0.4 OUTLIER -142.89 -178.56 5.87 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.421 -1.046 . . . . 0.0 109.466 -179.475 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.825 ' H ' HE21 ' A' ' 41' ' ' GLN . 0.0 OUTLIER -160.44 177.64 10.36 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 121.746 0.784 . . . . 0.0 110.736 -178.827 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.758 ' O ' HG22 ' A' ' 25' ' ' ILE . . . -163.69 135.82 3.97 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -108.03 -5.44 17.06 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -159.02 175.4 13.58 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -11.24 60.0 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.17 -0.956 . . . . 0.0 109.527 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -78.14 -31.77 49.98 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.936 -1.103 . . . . 0.0 110.149 -179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -42.9 91.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.002 -1.061 . . . . 0.0 109.549 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.587 ' CD1' ' C ' ' A' ' 48' ' ' PHE . 0.0 OUTLIER -55.83 -31.22 62.52 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.849 . . . . 0.0 109.342 -179.85 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.45 HG12 ' CE2' ' A' ' 48' ' ' PHE . 1.3 mt -83.2 -13.96 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.016 -1.052 . . . . 0.0 109.999 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -87.18 -52.53 5.36 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 120.612 -1.305 . . . . 0.0 109.77 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.583 ' OE1' ' NE2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -100.74 55.05 0.86 Allowed 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 110.896 -178.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.9 t -154.0 67.14 0.73 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.003 -1.06 . . . . 0.0 109.64 179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.59 ' C ' ' H ' ' A' ' 55' ' ' ASP . 7.6 p -84.44 154.9 22.5 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.248 -0.907 . . . . 0.0 110.003 -179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.581 ' O ' ' N ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER -58.05 8.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.478 -0.763 . . . . 0.0 110.482 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.59 ' H ' ' C ' ' A' ' 53' ' ' THR . 2.5 m-20 -109.95 26.78 10.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.095 -1.003 . . . . 0.0 109.366 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.555 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 0.8 OUTLIER -147.27 148.0 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.227 -0.921 . . . . 0.0 109.63 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.581 ' NH2' ' O ' ' A' ' 83' ' ' GLY . 3.2 ptp180 -130.47 133.61 46.43 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.445 -0.784 . . . . 0.0 110.329 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.775 ' C ' HD12 ' A' ' 58' ' ' LEU . 4.0 pp -172.63 179.51 2.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.584 -0.698 . . . . 0.0 109.279 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.513 ' O ' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -113.77 154.24 27.71 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.044 -1.035 . . . . 0.0 109.162 179.814 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.423 ' HA ' HG22 ' A' ' 28' ' ' THR . . . -139.39 159.14 42.85 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.015 -1.053 . . . . 0.0 109.294 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' CD2' ' A' ' 61' ' ' PHE . 15.0 t80 -148.5 107.56 3.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.641 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -121.48 153.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.339 -0.85 . . . . 0.0 109.641 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -87.08 108.39 18.86 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -90.2 155.5 18.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.278 -0.888 . . . . 0.0 109.927 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.417 ' H ' HG22 ' A' ' 65' ' ' THR . 1.0 OUTLIER -80.74 140.04 35.77 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.326 -0.859 . . . . 0.0 108.809 179.339 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.7 m -146.68 110.68 5.01 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.141 -0.974 . . . . 0.0 109.547 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.499 ' C ' ' H ' ' A' ' 69' ' ' ALA . . . 73.29 60.44 3.8 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.433 ' C ' ' OD1' ' A' ' 68' ' ' ASP . 55.8 p30 -70.45 38.29 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.293 -1.122 . . . . 0.0 109.476 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.499 ' H ' ' C ' ' A' ' 67' ' ' GLY . . . -100.43 159.8 14.85 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 109.454 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.423 ' C ' ' O ' ' A' ' 69' ' ' ALA . 27.2 mtt 43.83 -105.11 0.08 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.226 -0.921 . . . . 0.0 109.517 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.02 144.76 32.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.222 -0.924 . . . . 0.0 109.471 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.9 mttm -78.14 73.35 4.7 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.245 -0.909 . . . . 0.0 109.492 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.664 HH11 ' CG ' ' A' ' 73' ' ' ARG . 1.6 mtt-85 -74.19 173.84 9.57 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.211 -0.931 . . . . 0.0 109.458 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -150.0 157.07 42.78 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.3 -0.875 . . . . 0.0 109.456 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.659 ' HG2' HD22 ' A' ' 129' ' ' LEU . 14.5 tptm -105.22 153.84 21.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.318 -0.864 . . . . 0.0 109.751 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.471 ' O ' ' N ' ' A' ' 109' ' ' ALA . 78.6 m-85 -126.88 120.47 29.3 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.492 -0.755 . . . . 0.0 109.371 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -145.18 160.4 41.5 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.003 . . . . 0.0 110.496 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.8 tt -108.78 158.0 18.05 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 36.4 mt -138.31 143.64 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 120.931 -1.105 . . . . 0.0 108.928 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.22 120.26 41.36 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.193 -0.942 . . . . 0.0 109.696 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.555 ' CD1' ' O ' ' A' ' 56' ' ' VAL . 61.1 t-105 -93.15 112.02 23.84 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.136 -0.977 . . . . 0.0 109.611 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 38.1 mm -105.1 93.24 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 108.807 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.581 ' O ' ' NH2' ' A' ' 57' ' ' ARG . . . -64.67 160.4 41.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' A' ' 54' ' ' ASP . 2.4 mm-40 -121.13 71.43 0.95 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.617 -0.931 . . . . 0.0 109.766 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.513 ' O ' ' O ' ' A' ' 86' ' ' VAL . 0.4 OUTLIER -178.12 -24.93 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.05 -1.031 . . . . 0.0 110.067 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.513 ' O ' ' O ' ' A' ' 85' ' ' ASP . 1.9 t -59.51 -134.8 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.064 -1.022 . . . . 0.0 109.787 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.7 m -125.93 -177.73 4.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.507 -0.746 . . . . 0.0 110.121 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -84.15 -18.04 63.65 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.903 -1.279 . . . . 0.0 109.903 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mp -47.69 -57.05 6.01 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.186 -1.184 . . . . 0.0 109.864 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.497 ' O ' ' N ' ' A' ' 94' ' ' THR . 1.0 OUTLIER -62.37 -31.38 72.02 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.192 -0.942 . . . . 0.0 109.729 -179.708 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 90' ' ' GLN . 4.5 tpt180 -45.09 -65.79 0.49 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.753 -1.217 . . . . 0.0 110.042 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.61 -33.4 66.66 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.146 -0.971 . . . . 0.0 110.235 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.527 ' HG3' ' HH ' ' A' ' 31' ' ' TYR . 0.0 OUTLIER -69.47 -58.66 3.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.132 -0.98 . . . . 0.0 109.87 -179.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.497 ' N ' ' O ' ' A' ' 90' ' ' GLN . 3.5 m -44.64 -36.4 3.07 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.144 -0.972 . . . . 0.0 109.362 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -57.53 -57.1 21.55 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 110.021 -1.231 . . . . 0.0 110.021 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 m -66.45 -47.28 73.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.956 -1.32 . . . . 0.0 111.143 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.661 ' OD1' ' OH ' ' A' ' 31' ' ' TYR . 3.0 m-20 -69.17 -43.27 74.58 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.745 -1.222 . . . . 0.0 111.434 -177.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.88 -26.11 33.48 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.68 -1.262 . . . . 0.0 108.702 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 52.5 m -75.66 -29.85 59.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.318 -0.864 . . . . 0.0 108.917 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.7 -58.47 5.03 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.343 -0.848 . . . . 0.0 109.817 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 1.614 ' CG1' HD11 ' A' ' 5' ' ' ILE . 0.0 OUTLIER -65.85 -25.92 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.122 -0.986 . . . . 0.0 110.441 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.5 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.4 tttp -70.68 -37.99 73.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.06 -1.025 . . . . 0.0 109.945 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.456 ' C ' ' H ' ' A' ' 105' ' ' VAL . 27.6 tt0 -79.26 -37.35 38.09 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.159 -0.963 . . . . 0.0 110.528 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.8 HG21 ' CD ' ' A' ' 7' ' ' LYS . 2.9 p -73.19 18.56 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.016 -1.053 . . . . 0.0 110.029 -179.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 102' ' ' LYS . 4.5 p -98.31 133.5 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.107 -0.996 . . . . 0.0 109.635 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.49 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 0.0 OUTLIER -138.8 31.15 2.26 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.382 -0.969 . . . . 0.0 108.382 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.724 ' ND2' HD22 ' A' ' 15' ' ' ASN . 17.4 m-20 -136.09 -22.95 1.35 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.611 -0.68 . . . . 0.0 110.118 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PHE . . . . . 0.572 ' CD1' ' C ' ' A' ' 108' ' ' PHE . 0.1 OUTLIER -81.92 168.35 18.0 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.957 -1.089 . . . . 0.0 110.281 -179.491 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PHE . . . -109.07 -29.33 8.6 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.566 -0.709 . . . . 0.0 109.166 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -162.28 151.74 15.86 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 109.404 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.97 154.28 20.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.324 -0.86 . . . . 0.0 109.244 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -136.46 159.13 42.71 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.268 -0.895 . . . . 0.0 109.9 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 2.6 p -121.67 144.23 31.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.561 HG22 ' H ' ' A' ' 116' ' ' ASP . 4.7 mm -129.13 158.51 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.166 -0.959 . . . . 0.0 110.172 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.484 ' N ' HG22 ' A' ' 114' ' ' ILE . 88.8 p -138.73 2.2 2.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.561 ' H ' HG22 ' A' ' 114' ' ' ILE . 4.1 m-20 -145.35 154.1 41.95 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.291 -0.881 . . . . 0.0 109.446 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 22.9 ttp180 -73.56 -31.36 63.58 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.215 -0.928 . . . . 0.0 109.856 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -76.78 -6.99 54.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.129 -0.982 . . . . 0.0 109.483 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.599 ' O ' ' CD2' ' A' ' 124' ' ' PHE . 4.4 mm-40 -86.45 3.54 43.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.103 -0.998 . . . . 0.0 109.778 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.442 HD13 ' CE1' ' A' ' 48' ' ' PHE . 2.4 mt -105.97 13.95 28.61 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.271 -0.893 . . . . 0.0 109.001 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -64.62 148.54 50.68 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.514 -0.741 . . . . 0.0 109.793 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -59.25 -51.78 68.49 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.187 -0.946 . . . . 0.0 109.567 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -55.25 -21.92 16.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.303 -0.873 . . . . 0.0 109.738 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.599 ' CD2' ' O ' ' A' ' 119' ' ' GLU . 66.3 t80 -84.83 -49.07 8.74 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.293 -0.88 . . . . 0.0 109.143 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 4.1 mm -69.32 -12.45 16.05 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.765 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -82.37 -50.31 9.05 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.145 -0.972 . . . . 0.0 109.644 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -24.13 67.6 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.221 -0.925 . . . . 0.0 110.458 -179.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 129' ' ' LEU . 15.3 pt-20 -85.3 -39.77 17.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.96 -1.088 . . . . 0.0 109.713 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.659 HD22 ' HG2' ' A' ' 75' ' ' LYS . 5.4 mt -75.3 -36.26 61.17 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.121 -0.987 . . . . 0.0 108.664 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.2 -9.84 0.17 Allowed 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.192 -1.41 . . . . 0.0 107.192 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.55 ' N ' ' C ' ' A' ' 129' ' ' LEU . 8.5 tttp 61.84 106.13 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.817 0.818 . . . . 0.0 109.367 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -147.69 39.14 0.95 Allowed 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.848 -0.741 . . . . 0.0 109.513 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 49.5 -160.04 1.02 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 149.98 30.46 0.05 OUTLIER Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -157.67 -67.48 0.09 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.307 -1.114 . . . . 0.0 109.526 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -77.43 -22.44 51.47 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.255 -0.903 . . . . 0.0 109.524 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.98 -23.8 61.48 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.284 -0.885 . . . . 0.0 109.429 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . 0.557 ' N ' ' OD1' ' A' ' 138' ' ' ASP . 0.3 OUTLIER -152.94 70.18 0.87 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.213 -0.93 . . . . 0.0 109.498 179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -78.42 -56.57 4.34 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.212 -0.93 . . . . 0.0 109.414 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -86.82 -139.86 0.09 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.282 -0.886 . . . . 0.0 109.535 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -143.63 94.73 2.64 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.229 -0.92 . . . . 0.0 109.541 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.51 -179.962 . . . . . . . . 0 0 . 1 stop_ save_